[7-chloranyl-5-(2-chlorophenyl)-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-acetamidobutanoate

Systemtic Name: [7-chloranyl-5-(2-chlorophenyl)-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-acetamidobutanoate Openeye Name: [7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-acetamidobutanoate CAS Name: 4-acetamidobutanoic acid [7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] ester IUPAC Name: [7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-acetamidobutanoate Traditional Name: 4-acetamidobutyric acid [7-chloro-5-(2-chlorophenyl)-2-keto-1,3-dihydro-1,4-benzodiazepin-3-yl] ester Formula: C21H19Cl2N3O4 MolecularWeight: 448.29926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC(=O)OC1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)NCCCC(=O)OC1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H19Cl2N3O4/c1-12(27)24-10-4-7-18(28)30-21-20(29)25-17-9-8-13(22)11-15(17)19(26-21)14-5-2-3-6-16(14)23/h2-3,5-6,8-9,11,21H,4,7,10H2,1H3,(H,24,27)(H,25,29)