5-(2-chlorophenyl)-7-nitro-3-propan-2-yl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine

Systemtic Name: 5-(2-chlorophenyl)-7-nitro-3-propan-2-yl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine Openeye Name: 5-(2-chlorophenyl)-3-isopropyl-7-nitro-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine CAS Name: 5-(2-chlorophenyl)-7-nitro-3-propan-2-yl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine IUPAC Name: 5-(2-chlorophenyl)-7-nitro-3-propan-2-yl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine Traditional Name: 5-(2-chlorophenyl)-3-isopropyl-7-nitro-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine Formula: C19H16ClN5O2 MolecularWeight: 381.81564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)C4=CC=CC=C4Cl)NN1

Isomeric SMILES

CC(C)C1=C2C(=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)C4=CC=CC=C4Cl)NN1

InChI

InChI=1S/C19H16ClN5O2/c1-10(2)16-18-19(24-23-16)21-15-8-7-11(25(26)27)9-13(15)17(22-18)12-5-3-4-6-14(12)20/h3-10H,1-2H3,(H2,21,23,24)