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

Systemtic Name: 3-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]propanoic acid Openeye Name: 3-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]propanoic acid CAS Name: 3-[4-[[2-[(4-bromophenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-phenylpropanoyl]amino]phenyl]propanoic acid Traditional Name: 3-[4-[[2-(brosylamino)-3-phenyl-propanoyl]amino]phenyl]propionic acid Formula: C24H23BrN2O5S MolecularWeight: 531.41882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)CCC(=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)CCC(=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(16-18-4-2-1-3-5-18)24(30)26-20-11-6-17(7-12-20)8-15-23(28)29/h1-7,9-14,22,27H,8,15-16H2,(H,26,30)(H,28,29)