3-(4-nitropyrazol-1-yl)-1H-1,5-benzodiazepine

Systemtic Name: 3-(4-nitropyrazol-1-yl)-1H-1,5-benzodiazepine Openeye Name: 3-(4-nitropyrazol-1-yl)-1H-1,5-benzodiazepine CAS Name: 3-(4-nitro-1-pyrazolyl)-1H-1,5-benzodiazepine IUPAC Name: 3-(4-nitropyrazol-1-yl)-1H-1,5-benzodiazepine Traditional Name: 3-(4-nitropyrazol-1-yl)-1H-1,5-benzodiazepine Formula: C12H9N5O2 MolecularWeight: 255.23216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC=C(C=N2)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC=C(C=N2)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O2/c18-17(19)10-7-15-16(8-10)9-5-13-11-3-1-2-4-12(11)14-6-9/h1-8,13H