2-[[2-[(4-bromophenyl)sulfonylamino]-5-iodanyl-phenyl]carbonylamino]-3-(4-phenylphenyl)propanoic acid

Systemtic Name: 2-[[2-[(4-bromophenyl)sulfonylamino]-5-iodanyl-phenyl]carbonylamino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 2-[[2-[(4-bromophenyl)sulfonylamino]-5-iodo-benzoyl]amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 2-[[[2-[(4-bromophenyl)sulfonylamino]-5-iodophenyl]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 2-[[2-[(4-bromophenyl)sulfonylamino]-5-iodobenzoyl]amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 2-[[2-(brosylamino)-5-iodo-benzoyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C28H22BrIN2O5S MolecularWeight: 705.35815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=C(C=CC(=C3)I)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=C(C=CC(=C3)I)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H22BrIN2O5S/c29-21-10-13-23(14-11-21)38(36,37)32-25-15-12-22(30)17-24(25)27(33)31-26(28(34)35)16-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-15,17,26,32H,16H2,(H,31,33)(H,34,35)