methyl 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]benzoate CAS Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoate Traditional Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]benzoic acid methyl ester Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H13N3O2/c1-23-18(22)13-8-6-12(7-9-13)10-14(11-19)17-20-15-4-2-3-5-16(15)21-17/h2-10H,1H3,(H,20,21)/b14-10+