2-[(2-methylphenyl)methyl]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(2-methylphenyl)methyl]-3-sulfanyl-propanoic acid Openeye Name: 2-(o-tolylmethyl)-3-sulfanyl-propanoic acid CAS Name: 2-(mercaptomethyl)-3-(2-methylphenyl)propanoic acid IUPAC Name: 2-[(2-methylphenyl)methyl]-3-sulfanylpropanoic acid Traditional Name: 2-(mercaptomethyl)-3-(o-tolyl)propionic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(CS)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CC(CS)C(=O)O

InChI

InChI=1S/C11H14O2S/c1-8-4-2-3-5-9(8)6-10(7-14)11(12)13/h2-5,10,14H,6-7H2,1H3,(H,12,13)