[4-[2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] 4-methoxybenzoate

Systemtic Name: [4-[2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] 4-methoxybenzoate Openeye Name: [4-[2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-methoxy-phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-[2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C25H19N3O4 MolecularWeight: 425.43606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4N3)OC

InChI

InChI=1S/C25H19N3O4/c1-30-19-10-8-17(9-11-19)25(29)32-22-12-7-16(14-23(22)31-2)13-18(15-26)24-27-20-5-3-4-6-21(20)28-24/h3-14H,1-2H3,(H,27,28)