3-(pentan-3-ylsulfamoyl)benzoic acid

Systemtic Name: 3-(pentan-3-ylsulfamoyl)benzoic acid Openeye Name: 3-(1-ethylpropylsulfamoyl)benzoic acid CAS Name: 3-(pentan-3-ylsulfamoyl)benzoic acid IUPAC Name: 3-(pentan-3-ylsulfamoyl)benzoic acid Traditional Name: 3-(1-ethylpropylsulfamoyl)benzoic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4S/c1-3-10(4-2)13-18(16,17)11-7-5-6-9(8-11)12(14)15/h5-8,10,13H,3-4H2,1-2H3,(H,14,15)