4-[[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]amino]benzoic acid

Systemtic Name: 4-[[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]amino]benzoic acid Openeye Name: 4-[[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]amino]benzoic acid CAS Name: 4-[[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]amino]benzoic acid IUPAC Name: 4-[[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]amino]benzoic acid Traditional Name: 4-[[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]amino]benzoic acid Formula: C17H12N4O2 MolecularWeight: 304.30278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=CNC3=CC=C(C=C3)C(=O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)/C(=C/NC3=CC=C(C=C3)C(=O)O)/C#N

InChI

InChI=1S/C17H12N4O2/c18-9-12(16-20-14-3-1-2-4-15(14)21-16)10-19-13-7-5-11(6-8-13)17(22)23/h1-8,10,19H,(H,20,21)(H,22,23)/b12-10+