7-chloranyl-5-(2-methylpropyl)-9-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

Systemtic Name: 7-chloranyl-5-(2-methylpropyl)-9-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Openeye Name: 7-chloro-5-isobutyl-9-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine CAS Name: 7-chloro-5-(2-methylpropyl)-9-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine IUPAC Name: 7-chloro-5-(2-methylpropyl)-9-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Traditional Name: 7-chloro-5-isobutyl-9-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Formula: C13H18ClN3O2 MolecularWeight: 283.75392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C2=CC(=CC(=C2NCCN1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CC1C2=CC(=CC(=C2NCCN1)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H18ClN3O2/c1-8(2)5-11-10-6-9(14)7-12(17(18)19)13(10)16-4-3-15-11/h6-8,11,15-16H,3-5H2,1-2H3