2-(3-methylphenyl)sulfanylethanoic acid

Systemtic Name: 2-(3-methylphenyl)sulfanylethanoic acid Openeye Name: 2-(m-tolylsulfanyl)acetic acid CAS Name: 2-[(3-methylphenyl)thio]acetic acid IUPAC Name: 2-(3-methylphenyl)sulfanylacetic acid Traditional Name: 2-(m-tolylthio)acetic acid Formula: C9H10O2S MolecularWeight: 182.2395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)SCC(=O)O

InChI

InChI=1S/C9H10O2S/c1-7-3-2-4-8(5-7)12-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)