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

Systemtic Name: 2-(3-methylphenyl)-5-nitro-3-oxidanyl-N-phenethyl-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-2-(m-tolyl)-5-nitro-N-phenethyl-triazol-4-imine CAS Name: 3-hydroxy-2-(3-methylphenyl)-5-nitro-N-phenethyl-4-triazolimine IUPAC Name: 3-hydroxy-2-(3-methylphenyl)-5-nitro-N-phenethyltriazol-4-imine Traditional Name: [3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-ylidene]-phenethyl-amine Formula: C17H17N5O3 MolecularWeight: 339.34858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2N=C(C(=NCCC3=CC=CC=C3)N2O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2N=C(C(=NCCC3=CC=CC=C3)N2O)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3/c1-13-6-5-9-15(12-13)20-19-17(22(24)25)16(21(20)23)18-11-10-14-7-3-2-4-8-14/h2-9,12,23H,10-11H2,1H3