2-(4-methylphenyl)-4-nitro-1-oxidanidyl-benzotriazol-1-ium

Systemtic Name: 2-(4-methylphenyl)-4-nitro-1-oxidanidyl-benzotriazol-1-ium Openeye Name: 4-nitro-1-oxido-2-(p-tolyl)benzotriazol-1-ium CAS Name: 2-(4-methylphenyl)-4-nitro-1-oxidobenzotriazol-1-ium IUPAC Name: 2-(4-methylphenyl)-4-nitro-1-oxidobenzotriazol-1-ium Traditional Name: 4-nitro-1-oxido-2-(p-tolyl)benzotriazol-1-ium Formula: C13H10N4O3 MolecularWeight: 270.2435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C(=[N+]2[O-])C=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C(=[N+]2[O-])C=CC=C3[N+](=O)[O-]

InChI

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