2-methyl-2-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: 2-methyl-2-(phenylmethylsulfanyl)propanoic acid Openeye Name: 2-benzylsulfanyl-2-methyl-propanoic acid CAS Name: 2-methyl-2-(phenylmethylthio)propanoic acid IUPAC Name: 2-benzylsulfanyl-2-methylpropanoic acid Traditional Name: 2-(benzylthio)-2-methyl-propionic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O2S/c1-11(2,10(12)13)14-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,12,13)