methyl (3S,4S)-4-methyl-3-oxidanyl-5-(phenylsulfinyl)pentanoate

Systemtic Name: methyl (3S,4S)-4-methyl-3-oxidanyl-5-(phenylsulfinyl)pentanoate Openeye Name: methyl (3S,4S)-5-(benzenesulfinyl)-3-hydroxy-4-methyl-pentanoate CAS Name: (3S,4S)-5-(benzenesulfinyl)-3-hydroxy-4-methylpentanoic acid methyl ester IUPAC Name: methyl (3S,4S)-5-(benzenesulfinyl)-3-hydroxy-4-methylpentanoate Traditional Name: (3S,4S)-5-(benzenesulfinyl)-3-hydroxy-4-methyl-valeric acid methyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)C1=CC=CC=C1)C(CC(=O)OC)O

Isomeric SMILES

C[C@H](CS(=O)C1=CC=CC=C1)[C@H](CC(=O)OC)O

InChI

InChI=1S/C13H18O4S/c1-10(12(14)8-13(15)17-2)9-18(16)11-6-4-3-5-7-11/h3-7,10,12,14H,8-9H2,1-2H3/t10-,12+,18?/m1/s1