2-[ethanoyl(ethanoylsulfanyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[ethanoyl(ethanoylsulfanyl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[acetyl(acetylsulfanyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[acetyl-(acetylthio)amino]-3-phenylpropanoic acid IUPAC Name: 2-[acetyl(acetylsulfanyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[acetyl-(acetylthio)amino]-3-phenyl-propionic acid Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(CC1=CC=CC=C1)C(=O)O)SC(=O)C

Isomeric SMILES

CC(=O)N(C(CC1=CC=CC=C1)C(=O)O)SC(=O)C

InChI

InChI=1S/C13H15NO4S/c1-9(15)14(19-10(2)16)12(13(17)18)8-11-6-4-3-5-7-11/h3-7,12H,8H2,1-2H3,(H,17,18)