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

Systemtic Name: 4-bromanyl-2-propyl-5-sulfamoyl-benzoic acid Openeye Name: 4-bromo-2-propyl-5-sulfamoyl-benzoic acid CAS Name: 4-bromo-2-propyl-5-sulfamoylbenzoic acid IUPAC Name: 4-bromo-2-propyl-5-sulfamoylbenzoic acid Traditional Name: 4-bromo-2-propyl-5-sulfamoyl-benzoic acid Formula: C10H12BrNO4S MolecularWeight: 322.17558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Br

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Br

InChI

InChI=1S/C10H12BrNO4S/c1-2-3-6-4-8(11)9(17(12,15)16)5-7(6)10(13)14/h4-5H,2-3H2,1H3,(H,13,14)(H2,12,15,16)