8-nitro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 8-nitro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 8-nitro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 8-nitro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 8-nitro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 8-nitro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NN=CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=C4

Isomeric SMILES

C1C2=NN=CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=C4

InChI

InChI=1S/C16H11N5O2/c22-21(23)12-6-7-14-13(8-12)16(11-4-2-1-3-5-11)17-9-15-19-18-10-20(14)15/h1-8,10H,9H2