2-[(4-ethoxyphenyl)-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid

Systemtic Name: 2-[(4-ethoxyphenyl)-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid Openeye Name: 2-(4-ethoxy-N-(2-methyl-3-sulfanyl-propanoyl)anilino)acetic acid CAS Name: 2-(4-ethoxy-N-(3-mercapto-2-methyl-1-oxopropyl)anilino)acetic acid IUPAC Name: 2-(4-ethoxy-N-(2-methyl-3-sulfanylpropanoyl)anilino)acetic acid Traditional Name: 2-(4-ethoxy-N-(3-mercapto-2-methyl-propanoyl)anilino)acetic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)O)C(=O)C(C)CS

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)O)C(=O)C(C)CS

InChI

InChI=1S/C14H19NO4S/c1-3-19-12-6-4-11(5-7-12)15(8-13(16)17)14(18)10(2)9-20/h4-7,10,20H,3,8-9H2,1-2H3,(H,16,17)