4-bromanyl-3-(heptan-2-ylsulfamoyl)benzoic acid

Systemtic Name: 4-bromanyl-3-(heptan-2-ylsulfamoyl)benzoic acid Openeye Name: 4-bromo-3-(1-methylhexylsulfamoyl)benzoic acid CAS Name: 4-bromo-3-(heptan-2-ylsulfamoyl)benzoic acid IUPAC Name: 4-bromo-3-(heptan-2-ylsulfamoyl)benzoic acid Traditional Name: 4-bromo-3-(1-methylhexylsulfamoyl)benzoic acid Formula: C14H20BrNO4S MolecularWeight: 378.2819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Br

Isomeric SMILES

CCCCCC(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Br

InChI

InChI=1S/C14H20BrNO4S/c1-3-4-5-6-10(2)16-21(19,20)13-9-11(14(17)18)7-8-12(13)15/h7-10,16H,3-6H2,1-2H3,(H,17,18)