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

Systemtic Name: 5-nitro-3-oxidanyl-2-phenyl-N-(4-propan-2-ylphenyl)-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-N-(4-isopropylphenyl)-5-nitro-2-phenyl-triazol-4-imine CAS Name: 3-hydroxy-5-nitro-2-phenyl-N-(4-propan-2-ylphenyl)-4-triazolimine IUPAC Name: 3-hydroxy-5-nitro-2-phenyl-N-(4-propan-2-ylphenyl)triazol-4-imine Traditional Name: (3-hydroxy-5-nitro-2-phenyl-triazol-4-ylidene)-p-cumenyl-amine Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3/c1-12(2)13-8-10-14(11-9-13)18-16-17(22(24)25)19-20(21(16)23)15-6-4-3-5-7-15/h3-12,23H,1-2H3