2-bromanyl-4-butyl-5-sulfamoyl-benzoic acid

Systemtic Name: 2-bromanyl-4-butyl-5-sulfamoyl-benzoic acid Openeye Name: 2-bromo-4-butyl-5-sulfamoyl-benzoic acid CAS Name: 2-bromo-4-butyl-5-sulfamoylbenzoic acid IUPAC Name: 2-bromo-4-butyl-5-sulfamoylbenzoic acid Traditional Name: 2-bromo-4-butyl-5-sulfamoyl-benzoic acid Formula: C11H14BrNO4S MolecularWeight: 336.20216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C(=C1)Br)C(=O)O)S(=O)(=O)N

Isomeric SMILES

CCCCC1=C(C=C(C(=C1)Br)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C11H14BrNO4S/c1-2-3-4-7-5-9(12)8(11(14)15)6-10(7)18(13,16)17/h5-6H,2-4H2,1H3,(H,14,15)(H2,13,16,17)