3-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-benzoic acid

Systemtic Name: 3-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-benzoic acid Openeye Name: 3-(2-methoxy-2-oxo-ethyl)sulfanyl-2-methyl-benzoic acid CAS Name: 3-[(2-methoxy-2-oxoethyl)thio]-2-methylbenzoic acid IUPAC Name: 3-(2-methoxy-2-oxoethyl)sulfanyl-2-methylbenzoic acid Traditional Name: 3-[(2-keto-2-methoxy-ethyl)thio]-2-methyl-benzoic acid Formula: C11H12O4S MolecularWeight: 240.27558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCC(=O)OC)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1SCC(=O)OC)C(=O)O

InChI

InChI=1S/C11H12O4S/c1-7-8(11(13)14)4-3-5-9(7)16-6-10(12)15-2/h3-5H,6H2,1-2H3,(H,13,14)