ethyl (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-4-oxidanylidene-pentanoate

Systemtic Name: ethyl (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-4-oxidanylidene-pentanoate Openeye Name: ethyl (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-4-oxo-pentanoate CAS Name: (2S)-2-[(4-methoxyphenyl)methylthio]-2-methyl-4-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-4-oxopentanoate Traditional Name: (2S)-4-keto-2-methyl-2-(p-anisylthio)valeric acid ethyl ester Formula: C16H22O4S MolecularWeight: 310.40848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC(=O)C)SCC1=CC=C(C=C1)OC

Isomeric SMILES

CCOC(=O)[C@](C)(CC(=O)C)SCC1=CC=C(C=C1)OC

InChI

InChI=1S/C16H22O4S/c1-5-20-15(18)16(3,10-12(2)17)21-11-13-6-8-14(19-4)9-7-13/h6-9H,5,10-11H2,1-4H3/t16-/m0/s1