7-bromanyl-8-methoxy-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide

Systemtic Name: 7-bromanyl-8-methoxy-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Openeye Name: 7-bromo-8-methoxy-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide CAS Name: 7-bromo-8-methoxy-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide IUPAC Name: 7-bromo-8-methoxy-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Traditional Name: 7-bromo-8-methoxy-N,4-dimethyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Formula: C19H19BrN4O4 MolecularWeight: 447.28256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=C(C=C2C(=NN1C(=O)NC)C3=CC=C(C=C3)[N+](=O)[O-])OC)Br

Isomeric SMILES

CC1CC2=CC(=C(C=C2C(=NN1C(=O)NC)C3=CC=C(C=C3)[N+](=O)[O-])OC)Br

InChI

InChI=1S/C19H19BrN4O4/c1-11-8-13-9-16(20)17(28-3)10-15(13)18(22-23(11)19(25)21-2)12-4-6-14(7-5-12)24(26)27/h4-7,9-11H,8H2,1-3H3,(H,21,25)