7-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione

Systemtic Name: 7-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione Openeye Name: 7-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione CAS Name: 7-[[4-(4-nitrophenyl)-1-piperazinyl]sulfonyl]-1,5-dihydro-1,5-benzodiazepine-2,4-dione IUPAC Name: 7-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione Traditional Name: 7-[4-(4-nitrophenyl)piperazino]sulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-quinone Formula: C19H19N5O6S MolecularWeight: 445.44906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4

InChI

InChI=1S/C19H19N5O6S/c25-18-12-19(26)21-17-11-15(5-6-16(17)20-18)31(29,30)23-9-7-22(8-10-23)13-1-3-14(4-2-13)24(27)28/h1-6,11H,7-10,12H2,(H,20,25)(H,21,26)