3-(5-methyl-3,4-dihydropyrazol-2-yl)benzenesulfonic acid

Systemtic Name: 3-(5-methyl-3,4-dihydropyrazol-2-yl)benzenesulfonic acid Openeye Name: 3-(5-methyl-3,4-dihydropyrazol-2-yl)benzenesulfonic acid CAS Name: 3-(5-methyl-3,4-dihydropyrazol-2-yl)benzenesulfonic acid IUPAC Name: 3-(5-methyl-3,4-dihydropyrazol-2-yl)benzenesulfonic acid Traditional Name: 3-(3-methyl-2-pyrazolin-1-yl)besylic acid Formula: C10H12N2O3S MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(CC1)C2=CC(=CC=C2)S(=O)(=O)O

Isomeric SMILES

CC1=NN(CC1)C2=CC(=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C10H12N2O3S/c1-8-5-6-12(11-8)9-3-2-4-10(7-9)16(13,14)15/h2-4,7H,5-6H2,1H3,(H,13,14,15)