N-(1-methyl-1,2,4-triazol-4-ium-4-yl)-1-(3-nitrophenyl)methanimine

Systemtic Name: N-(1-methyl-1,2,4-triazol-4-ium-4-yl)-1-(3-nitrophenyl)methanimine Openeye Name: N-(1-methyl-1,2,4-triazol-4-ium-4-yl)-1-(3-nitrophenyl)methanimine CAS Name: N-(1-methyl-1,2,4-triazol-4-ium-4-yl)-1-(3-nitrophenyl)methanimine IUPAC Name: N-(1-methyl-1,2,4-triazol-4-ium-4-yl)-1-(3-nitrophenyl)methanimine Traditional Name: (E)-(1-methyl-1,2,4-triazol-4-ium-4-yl)-(3-nitrobenzylidene)amine Formula: C10H10N5O2+ MolecularWeight: 232.2187

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C=N1)N=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=[N+](C=N1)/N=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H10N5O2/c1-13-8-14(7-12-13)11-6-9-3-2-4-10(5-9)15(16)17/h2-8H,1H3/q+1/b11-6+