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

Systemtic Name: methyl 4-[[7-aminocarbonyl-3-(2-methylpropyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoate Openeye Name: methyl 4-[(7-carbamoyl-3-isobutyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-1-yl)methyl]benzoate CAS Name: 4-[[7-carbamoyl-3-(2-methylpropyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[7-carbamoyl-3-(2-methylpropyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-1-yl]methyl]benzoate Traditional Name: 4-[(7-carbamoyl-3-isobutyl-4-keto-3,5-dihydro-2H-1,5-benzodiazepin-1-yl)methyl]benzoic acid methyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CN(C2=C(C=C(C=C2)C(=O)N)NC1=O)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)CC1CN(C2=C(C=C(C=C2)C(=O)N)NC1=O)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H27N3O4/c1-14(2)10-18-13-26(12-15-4-6-16(7-5-15)23(29)30-3)20-9-8-17(21(24)27)11-19(20)25-22(18)28/h4-9,11,14,18H,10,12-13H2,1-3H3,(H2,24,27)(H,25,28)