7-[2-chloranyl-1-(dimethylamino)ethyl]-5-(2-nitrophenyl)-1H-1,5-benzodiazepine-2,4-dione

Systemtic Name: 7-[2-chloranyl-1-(dimethylamino)ethyl]-5-(2-nitrophenyl)-1H-1,5-benzodiazepine-2,4-dione Openeye Name: 7-[2-chloro-1-(dimethylamino)ethyl]-5-(2-nitrophenyl)-1H-1,5-benzodiazepine-2,4-dione CAS Name: 7-[2-chloro-1-(dimethylamino)ethyl]-5-(2-nitrophenyl)-1H-1,5-benzodiazepine-2,4-dione IUPAC Name: 7-[2-chloro-1-(dimethylamino)ethyl]-5-(2-nitrophenyl)-1H-1,5-benzodiazepine-2,4-dione Traditional Name: 7-[2-chloro-1-(dimethylamino)ethyl]-5-(2-nitrophenyl)-1H-1,5-benzodiazepine-2,4-quinone Formula: C19H19ClN4O4 MolecularWeight: 402.83156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CCl)C1=CC2=C(C=C1)NC(=O)CC(=O)N2C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C)C(CCl)C1=CC2=C(C=C1)NC(=O)CC(=O)N2C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O4/c1-22(2)17(11-20)12-7-8-13-16(9-12)23(19(26)10-18(25)21-13)14-5-3-4-6-15(14)24(27)28/h3-9,17H,10-11H2,1-2H3,(H,21,25)