2-acetamido-3-(3-oxidanyl-1-phenyl-propyl)sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-(3-oxidanyl-1-phenyl-propyl)sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-(3-hydroxy-1-phenyl-propyl)sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[(3-hydroxy-1-phenylpropyl)thio]propanoic acid IUPAC Name: 2-acetamido-3-(3-hydroxy-1-phenylpropyl)sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[(3-hydroxy-1-phenyl-propyl)thio]propionic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC(CCO)C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(=O)NC(CSC(CCO)C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H19NO4S/c1-10(17)15-12(14(18)19)9-20-13(7-8-16)11-5-3-2-4-6-11/h2-6,12-13,16H,7-9H2,1H3,(H,15,17)(H,18,19)