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

Systemtic Name: (4-chlorophenyl)methyl 7-nitro-2-oxidanylidene-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carboxylate Openeye Name: (4-chlorophenyl)methyl 7-nitro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carboxylate CAS Name: 7-nitro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 7-nitro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carboxylate Traditional Name: 2-keto-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carboxylic acid (4-chlorobenzyl) ester Formula: C23H18ClN3O5 MolecularWeight: 451.85912

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(N1C(=O)OCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(N1C(=O)OCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H18ClN3O5/c24-17-8-6-15(7-9-17)14-32-23(29)26-13-21(28)25-20-11-10-18(27(30)31)12-19(20)22(26)16-4-2-1-3-5-16/h1-12,22H,13-14H2,(H,25,28)