2-methyl-5-[[2-oxidanylidene-2-(propylamino)ethyl]sulfamoyl]benzoic acid

Systemtic Name: 2-methyl-5-[[2-oxidanylidene-2-(propylamino)ethyl]sulfamoyl]benzoic acid Openeye Name: 2-methyl-5-[[2-oxo-2-(propylamino)ethyl]sulfamoyl]benzoic acid CAS Name: 2-methyl-5-[[2-oxo-2-(propylamino)ethyl]sulfamoyl]benzoic acid IUPAC Name: 2-methyl-5-[[2-oxo-2-(propylamino)ethyl]sulfamoyl]benzoic acid Traditional Name: 5-[[2-keto-2-(propylamino)ethyl]sulfamoyl]-2-methyl-benzoic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)O

Isomeric SMILES

CCCNC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-3-6-14-12(16)8-15-21(19,20)10-5-4-9(2)11(7-10)13(17)18/h4-5,7,15H,3,6,8H2,1-2H3,(H,14,16)(H,17,18)