2-[(2-methoxyphenyl)-(3-sulfanylpropanoyl)amino]ethanoic acid

Systemtic Name: 2-[(2-methoxyphenyl)-(3-sulfanylpropanoyl)amino]ethanoic acid Openeye Name: 2-[2-methoxy-N-(3-sulfanylpropanoyl)anilino]acetic acid CAS Name: 2-(N-(3-mercapto-1-oxopropyl)-2-methoxyanilino)acetic acid IUPAC Name: 2-[2-methoxy-N-(3-sulfanylpropanoyl)anilino]acetic acid Traditional Name: 2-[N-(3-mercaptopropanoyl)-2-methoxy-anilino]acetic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CC(=O)O)C(=O)CCS

Isomeric SMILES

COC1=CC=CC=C1N(CC(=O)O)C(=O)CCS

InChI

InChI=1S/C12H15NO4S/c1-17-10-5-3-2-4-9(10)13(8-12(15)16)11(14)6-7-18/h2-5,18H,6-8H2,1H3,(H,15,16)