2-[(2,4-dimethoxyphenyl)-(3-sulfanylpropanoyl)amino]ethanoic acid

Systemtic Name: 2-[(2,4-dimethoxyphenyl)-(3-sulfanylpropanoyl)amino]ethanoic acid Openeye Name: 2-[2,4-dimethoxy-N-(3-sulfanylpropanoyl)anilino]acetic acid CAS Name: 2-(N-(3-mercapto-1-oxopropyl)-2,4-dimethoxyanilino)acetic acid IUPAC Name: 2-[2,4-dimethoxy-N-(3-sulfanylpropanoyl)anilino]acetic acid Traditional Name: 2-[N-(3-mercaptopropanoyl)-2,4-dimethoxy-anilino]acetic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N(CC(=O)O)C(=O)CCS)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N(CC(=O)O)C(=O)CCS)OC

InChI

InChI=1S/C13H17NO5S/c1-18-9-3-4-10(11(7-9)19-2)14(8-13(16)17)12(15)5-6-20/h3-4,7,20H,5-6,8H2,1-2H3,(H,16,17)