2-(3-methylphenyl)-5-nitro-3-oxidanyl-N-(pyridin-3-ylmethyl)-1,2,3-triazol-4-imine

Systemtic Name: 2-(3-methylphenyl)-5-nitro-3-oxidanyl-N-(pyridin-3-ylmethyl)-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-2-(m-tolyl)-5-nitro-N-(3-pyridylmethyl)triazol-4-imine CAS Name: 3-hydroxy-2-(3-methylphenyl)-5-nitro-N-(3-pyridinylmethyl)-4-triazolimine IUPAC Name: 3-hydroxy-2-(3-methylphenyl)-5-nitro-N-(pyridin-3-ylmethyl)triazol-4-imine Traditional Name: [3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-ylidene]-(3-pyridylmethyl)amine Formula: C15H14N6O3 MolecularWeight: 326.31006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2N=C(C(=NCC3=CN=CC=C3)N2O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2N=C(C(=NCC3=CN=CC=C3)N2O)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O3/c1-11-4-2-6-13(8-11)19-18-15(21(23)24)14(20(19)22)17-10-12-5-3-7-16-9-12/h2-9,22H,10H2,1H3