(4-chlorophenyl)methyl 7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3,5-dihydro-1,4-benzodiazepine-4-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3,5-dihydro-1,4-benzodiazepine-4-carboxylate Openeye Name: (4-chlorophenyl)methyl 7-chloro-1-methyl-2-oxo-5-phenyl-3,5-dihydro-1,4-benzodiazepine-4-carboxylate CAS Name: 7-chloro-1-methyl-2-oxo-5-phenyl-3,5-dihydro-1,4-benzodiazepine-4-carboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 7-chloro-1-methyl-2-oxo-5-phenyl-3,5-dihydro-1,4-benzodiazepine-4-carboxylate Traditional Name: 7-chloro-2-keto-1-methyl-5-phenyl-3,5-dihydro-1,4-benzodiazepine-4-carboxylic acid (4-chlorobenzyl) ester Formula: C24H20Cl2N2O3 MolecularWeight: 455.3332

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN(C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)CN(C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H20Cl2N2O3/c1-27-21-12-11-19(26)13-20(21)23(17-5-3-2-4-6-17)28(14-22(27)29)24(30)31-15-16-7-9-18(25)10-8-16/h2-13,23H,14-15H2,1H3