4-(4-methylphenyl)-1,2,3-triazole-1-sulfonic acid

Systemtic Name: 4-(4-methylphenyl)-1,2,3-triazole-1-sulfonic acid Openeye Name: 4-(p-tolyl)triazole-1-sulfonic acid CAS Name: 4-(4-methylphenyl)-1-triazolesulfonic acid IUPAC Name: 4-(4-methylphenyl)triazole-1-sulfonic acid Traditional Name: 4-(p-tolyl)triazole-1-sulfonic acid Formula: C9H9N3O3S MolecularWeight: 239.25106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN(N=N2)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN(N=N2)S(=O)(=O)O

InChI

InChI=1S/C9H9N3O3S/c1-7-2-4-8(5-3-7)9-6-12(11-10-9)16(13,14)15/h2-6H,1H3,(H,13,14,15)