[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3-methyl-2-oxidanyl-benzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3-methyl-2-oxidanyl-benzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 2-hydroxy-3-methyl-benzoate CAS Name: 2-hydroxy-3-methylbenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 2-hydroxy-3-methylbenzoate Traditional Name: 2-hydroxy-3-methyl-benzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)OCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)OCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C17H16O4S/c1-11-4-3-5-14(16(11)19)17(20)21-10-15(18)12-6-8-13(22-2)9-7-12/h3-9,19H,10H2,1-2H3