2-(2-methylphenyl)-6-nitro-1-oxidanidyl-benzotriazol-1-ium

Systemtic Name: 2-(2-methylphenyl)-6-nitro-1-oxidanidyl-benzotriazol-1-ium Openeye Name: 6-nitro-2-(o-tolyl)-1-oxido-benzotriazol-1-ium CAS Name: 2-(2-methylphenyl)-6-nitro-1-oxidobenzotriazol-1-ium IUPAC Name: 2-(2-methylphenyl)-6-nitro-1-oxidobenzotriazol-1-ium Traditional Name: 6-nitro-2-(o-tolyl)-1-oxido-benzotriazol-1-ium Formula: C13H10N4O3 MolecularWeight: 270.2435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2N=C3C=CC(=CC3=[N+]2[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2N=C3C=CC(=CC3=[N+]2[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O3/c1-9-4-2-3-5-12(9)15-14-11-7-6-10(17(19)20)8-13(11)16(15)18/h2-8H,1H3