2-[4-[[2-[(4-bromophenyl)sulfonylamino]-4-phenyl-butanoyl]amino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-4-phenyl-butanoyl]amino]phenyl]ethanoic acid Openeye Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-4-phenyl-butanoyl]amino]phenyl]acetic acid CAS Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-1-oxo-4-phenylbutyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-4-phenylbutanoyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[2-(brosylamino)-4-phenyl-butanoyl]amino]phenyl]acetic acid Formula: C24H23BrN2O5S MolecularWeight: 531.41882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)NC2=CC=C(C=C2)CC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)NC2=CC=C(C=C2)CC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H23BrN2O5S/c25-19-9-13-21(14-10-19)33(31,32)27-22(15-8-17-4-2-1-3-5-17)24(30)26-20-11-6-18(7-12-20)16-23(28)29/h1-7,9-14,22,27H,8,15-16H2,(H,26,30)(H,28,29)