2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-oxo-2-(p-tolyl)ethyl]sulfanylacetic acid CAS Name: 2-[[2-(4-methylphenyl)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-keto-2-(p-tolyl)ethyl]thio]acetic acid Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSCC(=O)O

InChI

InChI=1S/C11H12O3S/c1-8-2-4-9(5-3-8)10(12)6-15-7-11(13)14/h2-5H,6-7H2,1H3,(H,13,14)