3-[(4-bromophenyl)-ethyl-sulfamoyl]-5-methyl-benzoic acid

Systemtic Name: 3-[(4-bromophenyl)-ethyl-sulfamoyl]-5-methyl-benzoic acid Openeye Name: 3-[(4-bromophenyl)-ethyl-sulfamoyl]-5-methyl-benzoic acid CAS Name: 3-[(4-bromophenyl)-ethylsulfamoyl]-5-methylbenzoic acid IUPAC Name: 3-[(4-bromophenyl)-ethylsulfamoyl]-5-methylbenzoic acid Traditional Name: 3-[(4-bromophenyl)-ethyl-sulfamoyl]-5-methyl-benzoic acid Formula: C16H16BrNO4S MolecularWeight: 398.27154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)Br)S(=O)(=O)C2=CC(=CC(=C2)C)C(=O)O

Isomeric SMILES

CCN(C1=CC=C(C=C1)Br)S(=O)(=O)C2=CC(=CC(=C2)C)C(=O)O

InChI

InChI=1S/C16H16BrNO4S/c1-3-18(14-6-4-13(17)5-7-14)23(21,22)15-9-11(2)8-12(10-15)16(19)20/h4-10H,3H2,1-2H3,(H,19,20)