Property:Smiles

Purpose

Contains the formula/reaction in canonical Smiles-syntax

Datatype

String

Usage236

Filter<p>The <a target="_blank" rel="nofollow noreferrer noopener" class="external text" href="https://www.semantic-mediawiki.org/wiki/Help:Property_page/Filter">search filter</a> allows the inclusion of <a target="_blank" rel="nofollow noreferrer noopener" class="external text" href="https://www.semantic-mediawiki.org/wiki/Help:Query_expressions">query expressions</a> such as <code>~</code> or <code>!</code>. The selected <a target="_blank" rel="nofollow noreferrer noopener" class="external text" href="https://www.semantic-mediawiki.org/wiki/Query_engine">query engine</a> might also support case insensitive matching or other short expressions like:</p><ul><li><code>in:</code> result should include the term, e.g. '<code>in:Foo</code>'</li></ul><ul><li><code>not:</code> result should to not include the term, e.g. '<code>not:Bar</code>'</li></ul>

Showing 20 pages using this property.

1

100754 +

C1=C2/C(/C3C=CC=CC=3)=C3\N=C(/C(/C4C=CC=CC=4)=C4\[N-]/C(=C(/C5C=CC=CC=5)\C5=N/C(=C(/C6C=CC=CC=6)\C(=C1)[N-]2)/C=C5)/C=C\4)C=C\3.[Zn+2] +

100755 +

C1C2C(C)=N3[Fe+3]([Cl-])([Cl-])456N(CCN4CCN5CC3)=C(C)C(N=26)=CC=1.Cl([O-])(=O)(=O)=O +

100756 +

C(C1C(C)=CC(C)=CC=1C)1C=C2CP([Ir+3]([H-])([Cl-])34P(C5CCCCC5)(C5CCCCC5)CC5C=C(C6C(C)=CC(C)=CC=6C)C=C(C(C=1)=N23)N=54)(C1CCCCC1)C1CCCCC1.[B-](C1C=CC=CC=1)(C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1 +

100758 +

C1C=C2C3C=CC=CN=3[Ir+3]([Cl-])34(N5C(C6N3=C(C3N4=CC=CC=3)C=CC=6)=CC=CC=5)N2=CC=1.[P-](F)(F)(F)(F)(F)F.[P-](F)(F)(F)(F)(F)F +

100759 +

C1C2C(C)=N3[Co+2]456N(CCN4CCN5=C(C)C(N=26)=CC=1)CC3.Cl([O-])(=O)(=O)=O.Cl(=O)(=O)(=O)[O-] +

100760 +

C1C=C2C3C=CC=CN=3[Re+]([C-]#[O+])([C-]#[O+])3(N4C=CC=CC=4C4N3=CC=CC=4)N2=CC=1.S(C(F)(F)F)([O-])(=O)=O +

100761 +

C1C(C2C=CC(OC)=CC=2)=CC2OC3C=C(C4C=CC(OC)=CC=4)C=CC=3N(C3=CC4C=CC=CC=4C=C3)C=2C=1 +

100762 +

C1C(C2C=CC(C3C=CC(C#N)=CC=3)=CC=2)=CC2OC3C=C(C4C=CC(C5C=CC(C#N)=CC=5)=CC=4)C=CC=3N(C3=CC4C=CC=CC=4C=C3)C=2C=1 +

100763 +

C1C(C2C=CC(C(F)(F)F)=CC=2)=CC2OC3C=C(C4C=CC(C(F)(F)F)=CC=4)C=CC=3N(C3=CC4C=CC=CC=4C=C3)C=2C=1 +

100764 +

C1C2OC3C=C(C4C=CC(N(C5C=CC=CC=5)C5C=CC=CC=5)=CC=4)C=CC=3N(C3=CC4C=CC=CC=4C=C3)C=2C=CC=1C1C=CC(N(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1 +

100765 +

C12N(C3=CC4C=CC=CC=4C=C3)C3C=CC(C4=CC=C5C=CC6=CC=CC7C=CC4=C5C6=7)=CC=3OC=1C=C(C1=C3C=CC4=CC=CC5C=CC(=C3C4=5)C=C1)C=C2 +

100771 +

C(O)1C2C(=O)C3C=CC=CC=3C(=O)C=2C2[O-]~[Cu+2]3(~[O-]C4=CC(O)=C5C(=O)C6C=CC=CC=6C(=O)C5=C4[O-]~3)~[O-]C=2C=1.C(CCC)[N+](CCCC)(CCCC)CCCC.C(CCC)[N+](CCCC)(CCCC)CCCC +

100776 +

C1C=CC2CN3[Co+2]45N(CC3)3CCN4CC4C=CC=C(CN6CCN78[Co+2]6(N(CC7)CC=1C=2)(N(CC8)CC1C=C(CN5CC3)C=CC=1)[OH-])C=4.O=Cl(=O)(=O)[O-].O=Cl(=O)(=O)[O-].O=Cl(=O)(=O)[O-] +

100777 +

C1=CC=N2[Ru+2]3(N4=CC=CC5C=CC6=C(C=54)N3=CC=C6)3(N4=CC=CC5C=CC6=C(C=54)N3=CC=C6)N3=CC=CC4C=CC1=C2C=43.[P-](F)(F)(F)(F)(F)F.[P-](F)(F)(F)(F)(F)F +

100781 +

C1C=C2C3C=CC=CN=3[Re+]([C-]#[O+])([C-]#[O+])([C-]#[O+])(N#CC)N2=CC=1.[P-](F)(F)(F)(F)(F)F +

100784 +

C1C=C[C-]2[Ir+3]3([C-]4C=CC=CC=4C4C=CC=CN=43)3(N4=CC=CC=C4C4C=CC=CN=43)N3=CC=CC=C3C=2C=1.[P-](F)(F)(F)(F)(F)F +

100786 +

C1C2C3C=CC=C4C5C=CC=C6C7C=CC=CN=7[Fe+2](O)(O)(N=34)(N=56)N=2C=CC=1.Cl([O-])(=O)(=O)=O.Cl([O-])(=O)(=O)=O +

100787 +

C1C=N2[Ru+2]3(N4C(C5N3=CC=CC=5)=CC=CC=4)3(N4=CC=CC=C4C4=CC=CC=N43)N3=CC=CC=C3C2=CC=1.[Cl-].[Cl-] +

100788 +

C1C2C3C=CC=C4C5C=CC=C6C7C=CC=CN=7[Co+2](O)(O)(N=34)(N=56)N=2C=CC=1.Cl([O-])(=O)(=O)=O.Cl([O-])(=O)(=O)=O +

100789 +

Cl([O-])(=O)(=O)=O.Cl([O-])(=O)(=O)=O.[Co+2] +

Property:Smiles

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