3-bromanyl-4-(1-oxidanylbutan-2-ylsulfamoyl)benzoic acid

Systemtic Name: 3-bromanyl-4-(1-oxidanylbutan-2-ylsulfamoyl)benzoic acid Openeye Name: 3-bromo-4-[1-(hydroxymethyl)propylsulfamoyl]benzoic acid CAS Name: 3-bromo-4-(1-hydroxybutan-2-ylsulfamoyl)benzoic acid IUPAC Name: 3-bromo-4-(1-hydroxybutan-2-ylsulfamoyl)benzoic acid Traditional Name: 3-bromo-4-(1-methylolpropylsulfamoyl)benzoic acid Formula: C11H14BrNO5S MolecularWeight: 352.20156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br

Isomeric SMILES

CCC(CO)NS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br

InChI

InChI=1S/C11H14BrNO5S/c1-2-8(6-14)13-19(17,18)10-4-3-7(11(15)16)5-9(10)12/h3-5,8,13-14H,2,6H2,1H3,(H,15,16)