N-cyclohexyl-2,2,4-trimethyl-7-nitro-3,5-dihydro-1H-1,5-benzodiazepine-4-carboxamide

Systemtic Name: N-cyclohexyl-2,2,4-trimethyl-7-nitro-3,5-dihydro-1H-1,5-benzodiazepine-4-carboxamide Openeye Name: N-cyclohexyl-2,2,4-trimethyl-7-nitro-3,5-dihydro-1H-1,5-benzodiazepine-4-carboxamide CAS Name: N-cyclohexyl-2,2,4-trimethyl-7-nitro-3,5-dihydro-1H-1,5-benzodiazepine-4-carboxamide IUPAC Name: N-cyclohexyl-2,2,4-trimethyl-7-nitro-3,5-dihydro-1H-1,5-benzodiazepine-4-carboxamide Traditional Name: N-cyclohexyl-2,2,4-trimethyl-7-nitro-3,5-dihydro-1H-1,5-benzodiazepine-4-carboxamide Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(NC2=C(N1)C=CC(=C2)[N+](=O)[O-])(C)C(=O)NC3CCCCC3)C

Isomeric SMILES

CC1(CC(NC2=C(N1)C=CC(=C2)[N+](=O)[O-])(C)C(=O)NC3CCCCC3)C

InChI

InChI=1S/C19H28N4O3/c1-18(2)12-19(3,17(24)20-13-7-5-4-6-8-13)22-16-11-14(23(25)26)9-10-15(16)21-18/h9-11,13,21-22H,4-8,12H2,1-3H3,(H,20,24)