4-[2-[3,5-bis(chloranyl)-2-oxidanylidene-6-[[[3-(trifluoromethyloxy)phenyl]amino]methyl]pyridin-1-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[3,5-bis(chloranyl)-2-oxidanylidene-6-[[[3-(trifluoromethyloxy)phenyl]amino]methyl]pyridin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[3,5-dichloro-2-oxo-6-[[3-(trifluoromethoxy)anilino]methyl]-1-pyridyl]ethyl]benzoic acid CAS Name: 4-[2-[3,5-dichloro-2-oxo-6-[[3-(trifluoromethoxy)anilino]methyl]-1-pyridinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[3,5-dichloro-2-oxo-6-[[3-(trifluoromethoxy)anilino]methyl]pyridin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[3,5-dichloro-2-keto-6-[[3-(trifluoromethoxy)anilino]methyl]-1-pyridyl]ethyl]benzoic acid Formula: C22H17Cl2F3N2O4 MolecularWeight: 501.28259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)NCC2=C(C=C(C(=O)N2CCC3=CC=C(C=C3)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)NCC2=C(C=C(C(=O)N2CCC3=CC=C(C=C3)C(=O)O)Cl)Cl

InChI

InChI=1S/C22H17Cl2F3N2O4/c23-17-11-18(24)20(30)29(9-8-13-4-6-14(7-5-13)21(31)32)19(17)12-28-15-2-1-3-16(10-15)33-22(25,26)27/h1-7,10-11,28H,8-9,12H2,(H,31,32)