3,5-dimethylbenzenesulfonate

Systemtic Name: 3,5-dimethylbenzenesulfonate Openeye Name: 3,5-dimethylbenzenesulfonate CAS Name: 3,5-dimethylbenzenesulfonate IUPAC Name: 3,5-dimethylbenzenesulfonate Traditional Name: 3,5-dimethylbesylate Formula: C8H9O3S- MolecularWeight: 185.22026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)[O-])C

InChI

InChI=1S/C8H10O3S/c1-6-3-7(2)5-8(4-6)12(9,10)11/h3-5H,1-2H3,(H,9,10,11)/p-1