methyl 2-(2-methyl-5-oxidanylidene-oxolan-3-yl)sulfanylbenzoate

Systemtic Name: methyl 2-(2-methyl-5-oxidanylidene-oxolan-3-yl)sulfanylbenzoate Openeye Name: methyl 2-(2-methyl-5-oxo-tetrahydrofuran-3-yl)sulfanylbenzoate CAS Name: 2-[(2-methyl-5-oxo-3-oxolanyl)thio]benzoic acid methyl ester IUPAC Name: methyl 2-(2-methyl-5-oxooxolan-3-yl)sulfanylbenzoate Traditional Name: 2-[(5-keto-2-methyl-tetrahydrofuran-3-yl)thio]benzoic acid methyl ester Formula: C13H14O4S MolecularWeight: 266.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(=O)O1)SC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC1C(CC(=O)O1)SC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C13H14O4S/c1-8-11(7-12(14)17-8)18-10-6-4-3-5-9(10)13(15)16-2/h3-6,8,11H,7H2,1-2H3