7-chloranyl-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide

Systemtic Name: 7-chloranyl-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Openeye Name: 7-chloro-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide CAS Name: 7-chloro-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide IUPAC Name: 7-chloro-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Traditional Name: 7-chloro-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Formula: C18H17ClN4O3 MolecularWeight: 372.80558

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=CC(=C2)Cl)C(=NN1C(=O)NC)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(C=CC(=C2)Cl)C(=NN1C(=O)NC)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O3/c1-11-9-13-10-14(19)5-8-16(13)17(21-22(11)18(24)20-2)12-3-6-15(7-4-12)23(25)26/h3-8,10-11H,9H2,1-2H3,(H,20,24)