2-acetamido-3-[2,5-bis(oxidanyl)phenyl]sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-[2,5-bis(oxidanyl)phenyl]sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-(2,5-dihydroxyphenyl)sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[(2,5-dihydroxyphenyl)thio]propanoic acid IUPAC Name: 2-acetamido-3-(2,5-dihydroxyphenyl)sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[(2,5-dihydroxyphenyl)thio]propionic acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=C(C=CC(=C1)O)O)C(=O)O

Isomeric SMILES

CC(=O)NC(CSC1=C(C=CC(=C1)O)O)C(=O)O

InChI

InChI=1S/C11H13NO5S/c1-6(13)12-8(11(16)17)5-18-10-4-7(14)2-3-9(10)15/h2-4,8,14-15H,5H2,1H3,(H,12,13)(H,16,17)