butyl 2-(2-oxidanyl-2-phenyl-ethanoyl)sulfanylethanoate

Systemtic Name: butyl 2-(2-oxidanyl-2-phenyl-ethanoyl)sulfanylethanoate Openeye Name: butyl 2-(2-hydroxy-2-phenyl-acetyl)sulfanylacetate CAS Name: 2-[(2-hydroxy-1-oxo-2-phenylethyl)thio]acetic acid butyl ester IUPAC Name: butyl 2-(2-hydroxy-2-phenylacetyl)sulfanylacetate Traditional Name: 2-(mandeloylthio)acetic acid butyl ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC(=O)C(C1=CC=CC=C1)O

Isomeric SMILES

CCCCOC(=O)CSC(=O)C(C1=CC=CC=C1)O

InChI

InChI=1S/C14H18O4S/c1-2-3-9-18-12(15)10-19-14(17)13(16)11-7-5-4-6-8-11/h4-8,13,16H,2-3,9-10H2,1H3