2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]ethanoic acid Openeye Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]acetic acid CAS Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenylpropanoyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[2-(brosylamino)-3-phenyl-propanoyl]amino]phenyl]acetic acid Formula: C23H21BrN2O5S MolecularWeight: 517.39224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H21BrN2O5S/c24-18-8-12-20(13-9-18)32(30,31)26-21(14-16-4-2-1-3-5-16)23(29)25-19-10-6-17(7-11-19)15-22(27)28/h1-13,21,26H,14-15H2,(H,25,29)(H,27,28)