(3R)-3-methylsulfanyl-4-oxidanylidene-4-phenylmethoxy-butanoic acid

Systemtic Name: (3R)-3-methylsulfanyl-4-oxidanylidene-4-phenylmethoxy-butanoic acid Openeye Name: (3R)-4-benzyloxy-3-methylsulfanyl-4-oxo-butanoic acid CAS Name: (3R)-3-(methylthio)-4-oxo-4-phenylmethoxybutanoic acid IUPAC Name: (3R)-3-methylsulfanyl-4-oxo-4-phenylmethoxybutanoic acid Traditional Name: (3R)-4-benzoxy-4-keto-3-(methylthio)butyric acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(=O)O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CS[C@H](CC(=O)O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C12H14O4S/c1-17-10(7-11(13)14)12(15)16-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,14)/t10-/m1/s1