2-methoxy-3-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: 2-methoxy-3-(phenylmethylsulfanyl)propanoic acid Openeye Name: 3-benzylsulfanyl-2-methoxy-propanoic acid CAS Name: 2-methoxy-3-(phenylmethylthio)propanoic acid IUPAC Name: 3-benzylsulfanyl-2-methoxypropanoic acid Traditional Name: 3-(benzylthio)-2-methoxy-propionic acid Formula: C11H14O3S MolecularWeight: 226.29206

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Descriptors Computed from Structure

Canonical SMILES:

COC(CSCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

COC(CSCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C11H14O3S/c1-14-10(11(12)13)8-15-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,12,13)