5-methyl-2-(3-methylpyrazol-1-yl)benzenesulfonic acid

Systemtic Name: 5-methyl-2-(3-methylpyrazol-1-yl)benzenesulfonic acid Openeye Name: 5-methyl-2-(3-methylpyrazol-1-yl)benzenesulfonic acid CAS Name: 5-methyl-2-(3-methyl-1-pyrazolyl)benzenesulfonic acid IUPAC Name: 5-methyl-2-(3-methylpyrazol-1-yl)benzenesulfonic acid Traditional Name: 5-methyl-2-(3-methylpyrazol-1-yl)besylic acid Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC(=N2)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC(=N2)C)S(=O)(=O)O

InChI

InChI=1S/C11H12N2O3S/c1-8-3-4-10(11(7-8)17(14,15)16)13-6-5-9(2)12-13/h3-7H,1-2H3,(H,14,15,16)