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

Systemtic Name: 3-[4-[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[methyl-[2-(methylamino)-2-oxo-ethyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[methyl-[2-(methylamino)-2-oxoethyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[methyl-[2-(methylamino)-2-oxoethyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[2-keto-2-(methylamino)ethyl]-methyl-sulfamoyl]phenyl]propionic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CNC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-14-12(16)9-15(2)21(19,20)11-6-3-10(4-7-11)5-8-13(17)18/h3-4,6-7H,5,8-9H2,1-2H3,(H,14,16)(H,17,18)