(2R)-2-methyl-2-[2-(phenylmethylsulfanyl)ethyl]butanedioic acid

Systemtic Name: (2R)-2-methyl-2-[2-(phenylmethylsulfanyl)ethyl]butanedioic acid Openeye Name: (2R)-2-(2-benzylsulfanylethyl)-2-methyl-butanedioic acid CAS Name: (2R)-2-methyl-2-[2-(phenylmethylthio)ethyl]butanedioic acid IUPAC Name: (2R)-2-(2-benzylsulfanylethyl)-2-methylbutanedioic acid Traditional Name: (2R)-2-[2-(benzylthio)ethyl]-2-methyl-succinic acid Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSCC1=CC=CC=C1)(CC(=O)O)C(=O)O

Isomeric SMILES

C[C@](CCSCC1=CC=CC=C1)(CC(=O)O)C(=O)O

InChI

InChI=1S/C14H18O4S/c1-14(13(17)18,9-12(15)16)7-8-19-10-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,15,16)(H,17,18)/t14-/m0/s1