ethyl (2S)-2-[(4-methylphenyl)sulfanylmethyl]-2-oxidanyl-butanoate

Systemtic Name: ethyl (2S)-2-[(4-methylphenyl)sulfanylmethyl]-2-oxidanyl-butanoate Openeye Name: ethyl (2S)-2-hydroxy-2-(p-tolylsulfanylmethyl)butanoate CAS Name: (2S)-2-hydroxy-2-[[(4-methylphenyl)thio]methyl]butanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-hydroxy-2-[(4-methylphenyl)sulfanylmethyl]butanoate Traditional Name: (2S)-2-hydroxy-2-[(p-tolylthio)methyl]butyric acid ethyl ester Formula: C14H20O3S MolecularWeight: 268.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CSC1=CC=C(C=C1)C)(C(=O)OCC)O

Isomeric SMILES

CC[C@@](CSC1=CC=C(C=C1)C)(C(=O)OCC)O

InChI

InChI=1S/C14H20O3S/c1-4-14(16,13(15)17-5-2)10-18-12-8-6-11(3)7-9-12/h6-9,16H,4-5,10H2,1-3H3/t14-/m1/s1