2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(4-ethoxyanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(4-ethoxyanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-keto-2-(p-phenetidino)ethyl]thio]propionic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-3-18-11-6-4-10(5-7-11)14-12(15)8-19-9(2)13(16)17/h4-7,9H,3,8H2,1-2H3,(H,14,15)(H,16,17)