methyl 2-[[2-cyano-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethenyl]amino]benzoate

Systemtic Name: methyl 2-[[2-cyano-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethenyl]amino]benzoate Openeye Name: methyl 2-[[2-cyano-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)vinyl]amino]benzoate CAS Name: 2-[[2-cyano-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethenyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-cyano-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethenyl]amino]benzoate Traditional Name: 2-[[2-cyano-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)vinyl]amino]benzoic acid methyl ester Formula: C19H17N4O2+ MolecularWeight: 333.36388

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)C(=CNC3=CC=CC=C3C(=O)OC)C#N

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)C(=CNC3=CC=CC=C3C(=O)OC)C#N

InChI

InChI=1S/C19H16N4O2/c1-23-17-10-6-5-9-16(17)22-18(23)13(11-20)12-21-15-8-4-3-7-14(15)19(24)25-2/h3-10,12H,1-2H3,(H,21,22,24)/p+1