2-[[4-(3-methylbutanoylamino)phenyl]sulfamoyl]ethanoic acid

Systemtic Name: 2-[[4-(3-methylbutanoylamino)phenyl]sulfamoyl]ethanoic acid Openeye Name: 2-[[4-(3-methylbutanoylamino)phenyl]sulfamoyl]acetic acid CAS Name: 2-[[4-[(3-methyl-1-oxobutyl)amino]phenyl]sulfamoyl]acetic acid IUPAC Name: 2-[[4-(3-methylbutanoylamino)phenyl]sulfamoyl]acetic acid Traditional Name: 2-[[4-(isovalerylamino)phenyl]sulfamoyl]acetic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NS(=O)(=O)CC(=O)O

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NS(=O)(=O)CC(=O)O

InChI

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