hexyl 3-oxidanyl-2,3-dihydrothiophene-2-carboxylate

Systemtic Name: hexyl 3-oxidanyl-2,3-dihydrothiophene-2-carboxylate Openeye Name: hexyl 3-hydroxy-2,3-dihydrothiophene-2-carboxylate CAS Name: 3-hydroxy-2,3-dihydrothiophene-2-carboxylic acid hexyl ester IUPAC Name: hexyl 3-hydroxy-2,3-dihydrothiophene-2-carboxylate Traditional Name: 3-hydroxy-2,3-dihydrothiophene-2-carboxylic acid hexyl ester Formula: C11H18O3S MolecularWeight: 230.32382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1C(C=CS1)O

Isomeric SMILES

CCCCCCOC(=O)C1C(C=CS1)O

InChI

InChI=1S/C11H18O3S/c1-2-3-4-5-7-14-11(13)10-9(12)6-8-15-10/h6,8-10,12H,2-5,7H2,1H3