2-(2-methyl-3-sulfanylcarbonyl-phenyl)ethanoic acid

Systemtic Name: 2-(2-methyl-3-sulfanylcarbonyl-phenyl)ethanoic acid Openeye Name: 2-(2-methyl-3-sulfanylcarbonyl-phenyl)acetic acid CAS Name: 2-[3-[mercapto(oxo)methyl]-2-methylphenyl]acetic acid IUPAC Name: 2-(2-methyl-3-sulfanylcarbonylphenyl)acetic acid Traditional Name: 2-(2-methyl-3-thiocarboxy-phenyl)acetic acid Formula: C10H10O3S MolecularWeight: 210.2496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O3S/c1-6-7(5-9(11)12)3-2-4-8(6)10(13)14/h2-4H,5H2,1H3,(H,11,12)(H,13,14)