methyl 2-[7-[2-[4-(4-cyanophenyl)phenyl]ethyl]-2-oxidanylidene-3H-benzimidazol-1-yl]ethanoate

Systemtic Name: methyl 2-[7-[2-[4-(4-cyanophenyl)phenyl]ethyl]-2-oxidanylidene-3H-benzimidazol-1-yl]ethanoate Openeye Name: methyl 2-[7-[2-[4-(4-cyanophenyl)phenyl]ethyl]-2-oxo-3H-benzimidazol-1-yl]acetate CAS Name: 2-[7-[2-[4-(4-cyanophenyl)phenyl]ethyl]-2-oxo-3H-benzimidazol-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-[2-[4-(4-cyanophenyl)phenyl]ethyl]-2-oxo-3H-benzimidazol-1-yl]acetate Traditional Name: 2-[7-[2-[4-(4-cyanophenyl)phenyl]ethyl]-2-keto-3H-benzimidazol-1-yl]acetic acid methyl ester Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=CC=C2NC1=O)CCC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC(=O)CN1C2=C(C=CC=C2NC1=O)CCC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H21N3O3/c1-31-23(29)16-28-24-21(3-2-4-22(24)27-25(28)30)14-7-17-5-10-19(11-6-17)20-12-8-18(15-26)9-13-20/h2-6,8-13H,7,14,16H2,1H3,(H,27,30)