(2S)-2-ethanoylsulfanyl-3-(4-phenylmethoxycarbonyloxyphenyl)propanoic acid

Systemtic Name: (2S)-2-ethanoylsulfanyl-3-(4-phenylmethoxycarbonyloxyphenyl)propanoic acid Openeye Name: (2S)-2-acetylsulfanyl-3-(4-benzyloxycarbonyloxyphenyl)propanoic acid CAS Name: (2S)-2-(acetylthio)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoic acid IUPAC Name: (2S)-2-acetylsulfanyl-3-(4-phenylmethoxycarbonyloxyphenyl)propanoic acid Traditional Name: (2S)-2-(acetylthio)-3-(4-carbobenzoxyoxyphenyl)propionic acid Formula: C19H18O6S MolecularWeight: 374.40762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(=O)S[C@@H](CC1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H18O6S/c1-13(20)26-17(18(21)22)11-14-7-9-16(10-8-14)25-19(23)24-12-15-5-3-2-4-6-15/h2-10,17H,11-12H2,1H3,(H,21,22)/t17-/m0/s1