(2S)-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenyl-propanoic acid CAS Name: (2S)-2-[(4-methoxyphenyl)methylthio]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylpropanoic acid Traditional Name: (2S)-2-(p-anisylthio)-3-phenyl-propionic acid Formula: C17H18O3S MolecularWeight: 302.38802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CS[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H18O3S/c1-20-15-9-7-14(8-10-15)12-21-16(17(18)19)11-13-5-3-2-4-6-13/h2-10,16H,11-12H2,1H3,(H,18,19)/t16-/m0/s1