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

Systemtic Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-(4-chloranylphenoxy)propanoyl]amino]phenyl]ethanoic acid Openeye Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-(4-chlorophenoxy)propanoyl]amino]phenyl]acetic acid CAS Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-(4-chlorophenoxy)-1-oxopropyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[2-[(4-bromophenyl)sulfonylamino]-3-(4-chlorophenoxy)propanoyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[2-(brosylamino)-3-(4-chlorophenoxy)propanoyl]amino]phenyl]acetic acid Formula: C23H20BrClN2O6S MolecularWeight: 567.8367

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NC(=O)C(COC2=CC=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NC(=O)C(COC2=CC=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H20BrClN2O6S/c24-16-3-11-20(12-4-16)34(31,32)27-21(14-33-19-9-5-17(25)6-10-19)23(30)26-18-7-1-15(2-8-18)13-22(28)29/h1-12,21,27H,13-14H2,(H,26,30)(H,28,29)