3-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylpropanoate

Systemtic Name: 3-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylpropanoate Openeye Name: 3-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfonylpropanoate CAS Name: 3-[2-(3-methoxyanilino)-2-oxoethyl]sulfonylpropanoate IUPAC Name: 3-[2-(3-methoxyanilino)-2-oxoethyl]sulfonylpropanoate Traditional Name: 3-[2-keto-2-(m-anisidino)ethyl]sulfonylpropionate Formula: C12H14NO6S- MolecularWeight: 300.30766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CS(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CS(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H15NO6S/c1-19-10-4-2-3-9(7-10)13-11(14)8-20(17,18)6-5-12(15)16/h2-4,7H,5-6,8H2,1H3,(H,13,14)(H,15,16)/p-1