3-[4-[[2-(methylamino)-2-oxidanylidene-ethyl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[2-(methylamino)-2-oxidanylidene-ethyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[2-(methylamino)-2-oxo-ethyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[2-(methylamino)-2-oxoethyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[2-(methylamino)-2-oxoethyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[2-keto-2-(methylamino)ethyl]sulfamoyl]phenyl]propionic acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CNC(=O)CNS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C12H16N2O5S/c1-13-11(15)8-14-20(18,19)10-5-2-9(3-6-10)4-7-12(16)17/h2-3,5-6,14H,4,7-8H2,1H3,(H,13,15)(H,16,17)