3-(3-methylphenyl)-2-sulfanyl-propanoic acid

Systemtic Name: 3-(3-methylphenyl)-2-sulfanyl-propanoic acid Openeye Name: 3-(m-tolyl)-2-sulfanyl-propanoic acid CAS Name: 2-mercapto-3-(3-methylphenyl)propanoic acid IUPAC Name: 3-(3-methylphenyl)-2-sulfanylpropanoic acid Traditional Name: 2-mercapto-3-(m-tolyl)propionic acid Formula: C10H12O2S MolecularWeight: 196.26608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O2S/c1-7-3-2-4-8(5-7)6-9(13)10(11)12/h2-5,9,13H,6H2,1H3,(H,11,12)