2-(4-methylphenyl)sulfanyl-2-oxidanyl-ethanoate

Systemtic Name: 2-(4-methylphenyl)sulfanyl-2-oxidanyl-ethanoate Openeye Name: 2-hydroxy-2-(p-tolylsulfanyl)acetate CAS Name: 2-hydroxy-2-[(4-methylphenyl)thio]acetate IUPAC Name: 2-hydroxy-2-(4-methylphenyl)sulfanylacetate Traditional Name: 2-hydroxy-2-(p-tolylthio)acetate Formula: C9H9O3S- MolecularWeight: 197.23096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O3S/c1-6-2-4-7(5-3-6)13-9(12)8(10)11/h2-5,9,12H,1H3,(H,10,11)/p-1