methyl 2-[(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanylmethyl]butanoate

Systemtic Name: methyl 2-[(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanylmethyl]butanoate Openeye Name: methyl 2-[(2-isopropoxy-2-oxo-ethyl)sulfanylmethyl]butanoate CAS Name: 2-[[(2-oxo-2-propan-2-yloxyethyl)thio]methyl]butanoic acid methyl ester IUPAC Name: methyl 2-[(2-oxo-2-propan-2-yloxyethyl)sulfanylmethyl]butanoate Traditional Name: 2-[[(2-isopropoxy-2-keto-ethyl)thio]methyl]butyric acid methyl ester Formula: C11H20O4S MolecularWeight: 248.3391

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CSCC(=O)OC(C)C)C(=O)OC

Isomeric SMILES

CCC(CSCC(=O)OC(C)C)C(=O)OC

InChI

InChI=1S/C11H20O4S/c1-5-9(11(13)14-4)6-16-7-10(12)15-8(2)3/h8-9H,5-7H2,1-4H3