dimethyl (2S,3R)-2-methyl-3-phenylsulfanyl-butanedioate

Systemtic Name: dimethyl (2S,3R)-2-methyl-3-phenylsulfanyl-butanedioate Openeye Name: dimethyl (2S,3R)-2-methyl-3-phenylsulfanyl-butanedioate CAS Name: (2S,3R)-2-methyl-3-(phenylthio)butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S,3R)-2-methyl-3-phenylsulfanylbutanedioate Traditional Name: (2S,3R)-2-methyl-3-(phenylthio)succinic acid dimethyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)SC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

C[C@H]([C@H](C(=O)OC)SC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C13H16O4S/c1-9(12(14)16-2)11(13(15)17-3)18-10-7-5-4-6-8-10/h4-9,11H,1-3H3/t9-,11-/m1/s1