N-(2-methoxy-5-methyl-phenyl)-2-(2-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-(2-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-N-(2-methoxy-5-methyl-phenyl)-5-nitro-2-(o-tolyl)triazol-4-imine CAS Name: 3-hydroxy-N-(2-methoxy-5-methylphenyl)-2-(2-methylphenyl)-5-nitro-4-triazolimine IUPAC Name: 3-hydroxy-N-(2-methoxy-5-methylphenyl)-2-(2-methylphenyl)-5-nitrotriazol-4-imine Traditional Name: [3-hydroxy-5-nitro-2-(o-tolyl)triazol-4-ylidene]-(2-methoxy-5-methyl-phenyl)amine Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N=C2C(=NN(N2O)C3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N=C2C(=NN(N2O)C3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c1-11-8-9-15(26-3)13(10-11)18-16-17(22(24)25)19-20(21(16)23)14-7-5-4-6-12(14)2/h4-10,23H,1-3H3