2-(4-methoxyphenyl)-N-[(4-methylphenyl)methyl]-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O4/c1-12-3-5-13(6-4-12)11-18-16-17(22(24)25)19-20(21(16)23)14-7-9-15(26-2)10-8-14/h3-10,23H,11H2,1-2H3