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

Systemtic Name: 3-bromanyl-4-(heptan-2-ylsulfamoyl)benzoic acid Openeye Name: 3-bromo-4-(1-methylhexylsulfamoyl)benzoic acid CAS Name: 3-bromo-4-(heptan-2-ylsulfamoyl)benzoic acid IUPAC Name: 3-bromo-4-(heptan-2-ylsulfamoyl)benzoic acid Traditional Name: 3-bromo-4-(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=C(C=C1)C(=O)O)Br

Isomeric SMILES

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

InChI

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