2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylpropanoic acid

Systemtic Name: 2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylpropanoic acid Openeye Name: 2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfonylpropanoic acid CAS Name: 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfonylpropanoic acid IUPAC Name: 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfonylpropanoic acid Traditional Name: 2-[2-keto-2-(p-anisidino)ethyl]sulfonylpropionic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)CC(=O)NC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C(=O)O)S(=O)(=O)CC(=O)NC1=CC=C(C=C1)OC

InChI

InChI=1S/C12H15NO6S/c1-8(12(15)16)20(17,18)7-11(14)13-9-3-5-10(19-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,13,14)(H,15,16)