5-methyl-2-(4-methylphenyl)benzotriazol-1-ium

Systemtic Name: 5-methyl-2-(4-methylphenyl)benzotriazol-1-ium Openeye Name: 5-methyl-2-(p-tolyl)benzotriazol-1-ium CAS Name: 5-methyl-2-(4-methylphenyl)benzotriazol-1-ium IUPAC Name: 5-methyl-2-(4-methylphenyl)benzotriazol-1-ium Traditional Name: 5-methyl-2-(p-tolyl)benzotriazol-1-ium Formula: C14H14N3+ MolecularWeight: 224.28106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2[NH+]=C3C=CC(=CC3=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2[NH+]=C3C=CC(=CC3=N2)C

InChI

InChI=1S/C14H13N3/c1-10-3-6-12(7-4-10)17-15-13-8-5-11(2)9-14(13)16-17/h3-9H,1-2H3/p+1