4-[2-(2,2-dicyanoethenyl)pyrrol-1-yl]benzoic acid

Systemtic Name: 4-[2-(2,2-dicyanoethenyl)pyrrol-1-yl]benzoic acid Openeye Name: 4-[2-(2,2-dicyanovinyl)pyrrol-1-yl]benzoic acid CAS Name: 4-[2-(2,2-dicyanoethenyl)-1-pyrrolyl]benzoic acid IUPAC Name: 4-[2-(2,2-dicyanoethenyl)pyrrol-1-yl]benzoic acid Traditional Name: 4-[2-(2,2-dicyanovinyl)pyrrol-1-yl]benzoic acid Formula: C15H9N3O2 MolecularWeight: 263.25086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=C(C#N)C#N)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CN(C(=C1)C=C(C#N)C#N)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H9N3O2/c16-9-11(10-17)8-14-2-1-7-18(14)13-5-3-12(4-6-13)15(19)20/h1-8H,(H,19,20)