methyl 5-butyl-4-oxidanylidene-thiolane-3-carboxylate

Systemtic Name: methyl 5-butyl-4-oxidanylidene-thiolane-3-carboxylate Openeye Name: methyl 5-butyl-4-oxo-tetrahydrothiophene-3-carboxylate CAS Name: 5-butyl-4-oxo-3-thiolanecarboxylic acid methyl ester IUPAC Name: methyl 5-butyl-4-oxothiolane-3-carboxylate Traditional Name: 5-butyl-4-keto-tetrahydrothiophene-3-carboxylic acid methyl ester Formula: C10H16O3S MolecularWeight: 216.29724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)C(CS1)C(=O)OC

Isomeric SMILES

CCCCC1C(=O)C(CS1)C(=O)OC

InChI

InChI=1S/C10H16O3S/c1-3-4-5-8-9(11)7(6-14-8)10(12)13-2/h7-8H,3-6H2,1-2H3