methyl 4-[[7-aminocarbonyl-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[7-aminocarbonyl-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[7-carbamoyl-3-[(4-methoxyphenyl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoate CAS Name: 4-[[7-carbamoyl-3-[(4-methoxyphenyl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[7-carbamoyl-3-[(4-methoxyphenyl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoate Traditional Name: 4-[(7-carbamoyl-4-keto-3-p-anisyl-3,5-dihydro-2H-1,5-benzodiazepin-1-yl)methyl]benzoic acid methyl ester Formula: C27H27N3O5 MolecularWeight: 473.52038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2CN(C3=C(C=C(C=C3)C(=O)N)NC2=O)CC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CC2CN(C3=C(C=C(C=C3)C(=O)N)NC2=O)CC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C27H27N3O5/c1-34-22-10-5-17(6-11-22)13-21-16-30(15-18-3-7-19(8-4-18)27(33)35-2)24-12-9-20(25(28)31)14-23(24)29-26(21)32/h3-12,14,21H,13,15-16H2,1-2H3,(H2,28,31)(H,29,32)