methyl 5-[[3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]indol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]indol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]indol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-1-indolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[3-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]indol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C25H18N4O3 MolecularWeight: 422.43542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2C=C(C3=CC=CC=C32)C=C(C#N)C4=NC5=CC=CC=C5N4

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2C=C(C3=CC=CC=C32)/C=C(/C#N)\C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H18N4O3/c1-31-25(30)23-11-10-18(32-23)15-29-14-17(19-6-2-5-9-22(19)29)12-16(13-26)24-27-20-7-3-4-8-21(20)28-24/h2-12,14H,15H2,1H3,(H,27,28)/b16-12-