(6-phenoxypyridin-2-yl)methyl 2-[[3-[2-chloranyl-4-(trifluoromethyl)phenoxy]pyridin-2-yl]methyl]-2-[[2-chloranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate

Systemtic Name: (6-phenoxypyridin-2-yl)methyl 2-[[3-[2-chloranyl-4-(trifluoromethyl)phenoxy]pyridin-2-yl]methyl]-2-[[2-chloranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate Openeye Name: (6-phenoxy-2-pyridyl)methyl 2-[2-chloro-4-(trifluoromethyl)anilino]-2-[[3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-pyridyl]methyl]-3-methyl-butanoate CAS Name: 2-[2-chloro-4-(trifluoromethyl)anilino]-2-[[3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-pyridinyl]methyl]-3-methylbutanoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl 2-[2-chloro-4-(trifluoromethyl)anilino]-2-[[3-[2-chloro-4-(trifluoromethyl)phenoxy]pyridin-2-yl]methyl]-3-methylbutanoate Traditional Name: 2-[2-chloro-4-(trifluoromethyl)anilino]-2-[[3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-pyridyl]methyl]-3-methyl-butyric acid (6-phenoxy-2-pyridyl)methyl ester Formula: C37H29Cl2F6N3O4 MolecularWeight: 764.540279

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=C(C=CC=N1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)(C(=O)OCC3=NC(=CC=C3)OC4=CC=CC=C4)NC5=C(C=C(C=C5)C(F)(F)F)Cl

Isomeric SMILES

CC(C)C(CC1=C(C=CC=N1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)(C(=O)OCC3=NC(=CC=C3)OC4=CC=CC=C4)NC5=C(C=C(C=C5)C(F)(F)F)Cl

InChI

InChI=1S/C37H29Cl2F6N3O4/c1-22(2)35(48-29-15-13-23(18-27(29)38)36(40,41)42,34(49)50-21-25-8-6-12-33(47-25)51-26-9-4-3-5-10-26)20-30-32(11-7-17-46-30)52-31-16-14-24(19-28(31)39)37(43,44)45/h3-19,22,48H,20-21H2,1-2H3