methyl 3-methyl-5-methylsulfanyl-2-(phenylcarbonyl)benzoate

Systemtic Name: methyl 3-methyl-5-methylsulfanyl-2-(phenylcarbonyl)benzoate Openeye Name: methyl 2-benzoyl-3-methyl-5-methylsulfanyl-benzoate CAS Name: 2-benzoyl-3-methyl-5-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 2-benzoyl-3-methyl-5-methylsulfanylbenzoate Traditional Name: 2-benzoyl-3-methyl-5-(methylthio)benzoic acid methyl ester Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)SC)C(=O)OC)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=CC(=C1)SC)C(=O)OC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16O3S/c1-11-9-13(21-3)10-14(17(19)20-2)15(11)16(18)12-7-5-4-6-8-12/h4-10H,1-3H3