N-(4-bromophenyl)-5-nitro-3-oxidanyl-2-phenyl-1,2,3-triazol-4-imine

Systemtic Name: N-(4-bromophenyl)-5-nitro-3-oxidanyl-2-phenyl-1,2,3-triazol-4-imine Openeye Name: N-(4-bromophenyl)-3-hydroxy-5-nitro-2-phenyl-triazol-4-imine CAS Name: N-(4-bromophenyl)-3-hydroxy-5-nitro-2-phenyl-4-triazolimine IUPAC Name: N-(4-bromophenyl)-3-hydroxy-5-nitro-2-phenyltriazol-4-imine Traditional Name: (4-bromophenyl)-(3-hydroxy-5-nitro-2-phenyl-triazol-4-ylidene)amine Formula: C14H10BrN5O3 MolecularWeight: 376.1649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C(C(=NC3=CC=C(C=C3)Br)N2O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2N=C(C(=NC3=CC=C(C=C3)Br)N2O)[N+](=O)[O-]

InChI

InChI=1S/C14H10BrN5O3/c15-10-6-8-11(9-7-10)16-13-14(20(22)23)17-18(19(13)21)12-4-2-1-3-5-12/h1-9,21H