methyl 4-oxidanylidene-5-propan-2-yl-thiolane-3-carboxylate

Systemtic Name: methyl 4-oxidanylidene-5-propan-2-yl-thiolane-3-carboxylate Openeye Name: methyl 5-isopropyl-4-oxo-tetrahydrothiophene-3-carboxylate CAS Name: 4-oxo-5-propan-2-yl-3-thiolanecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-5-propan-2-ylthiolane-3-carboxylate Traditional Name: 5-isopropyl-4-keto-tetrahydrothiophene-3-carboxylic acid methyl ester Formula: C9H14O3S MolecularWeight: 202.27066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)C(CS1)C(=O)OC

Isomeric SMILES

CC(C)C1C(=O)C(CS1)C(=O)OC

InChI

InChI=1S/C9H14O3S/c1-5(2)8-7(10)6(4-13-8)9(11)12-3/h5-6,8H,4H2,1-3H3