3-(4-chlorophenyl)-2-[2-oxidanylidene-5-(4-phenoxyphenyl)-3-[[4-(trifluoromethyl)phenyl]carbonylamino]pyridin-1-yl]propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-2-[2-oxidanylidene-5-(4-phenoxyphenyl)-3-[[4-(trifluoromethyl)phenyl]carbonylamino]pyridin-1-yl]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[2-oxo-5-(4-phenoxyphenyl)-3-[[4-(trifluoromethyl)benzoyl]amino]-1-pyridyl]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[2-oxo-3-[[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]-5-(4-phenoxyphenyl)-1-pyridinyl]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[2-oxo-5-(4-phenoxyphenyl)-3-[[4-(trifluoromethyl)benzoyl]amino]pyridin-1-yl]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[2-keto-5-(4-phenoxyphenyl)-3-[[4-(trifluoromethyl)benzoyl]amino]-1-pyridyl]propionic acid Formula: C34H24ClF3N2O5 MolecularWeight: 633.01297

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CN(C(=O)C(=C3)NC(=O)C4=CC=C(C=C4)C(F)(F)F)C(CC5=CC=C(C=C5)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CN(C(=O)C(=C3)NC(=O)C4=CC=C(C=C4)C(F)(F)F)C(CC5=CC=C(C=C5)Cl)C(=O)O

InChI

InChI=1S/C34H24ClF3N2O5/c35-26-14-6-21(7-15-26)18-30(33(43)44)40-20-24(22-10-16-28(17-11-22)45-27-4-2-1-3-5-27)19-29(32(40)42)39-31(41)23-8-12-25(13-9-23)34(36,37)38/h1-17,19-20,30H,18H2,(H,39,41)(H,43,44)