(2R)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfonylbutanoate

Systemtic Name: (2R)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfonylbutanoate Openeye Name: (2R)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfonylbutanoate CAS Name: (2R)-2-[2-(4-methylanilino)-2-oxoethyl]sulfonylbutanoate IUPAC Name: (2R)-2-[2-(4-methylanilino)-2-oxoethyl]sulfonylbutanoate Traditional Name: (2R)-2-[2-keto-2-(p-toluidino)ethyl]sulfonylbutyrate Formula: C13H16NO5S- MolecularWeight: 298.33484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])S(=O)(=O)CC(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CC[C@H](C(=O)[O-])S(=O)(=O)CC(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C13H17NO5S/c1-3-11(13(16)17)20(18,19)8-12(15)14-10-6-4-9(2)5-7-10/h4-7,11H,3,8H2,1-2H3,(H,14,15)(H,16,17)/p-1/t11-/m1/s1