[cyano-(6-phenoxypyridin-2-yl)methyl] 3-methyl-2-[4-(trifluoromethyloxy)phenyl]butanoate

Systemtic Name: [cyano-(6-phenoxypyridin-2-yl)methyl] 3-methyl-2-[4-(trifluoromethyloxy)phenyl]butanoate Openeye Name: [cyano-(6-phenoxy-2-pyridyl)methyl] 3-methyl-2-[4-(trifluoromethoxy)phenyl]butanoate CAS Name: 3-methyl-2-[4-(trifluoromethoxy)phenyl]butanoic acid [cyano-(6-phenoxy-2-pyridinyl)methyl] ester IUPAC Name: [cyano-(6-phenoxypyridin-2-yl)methyl] 3-methyl-2-[4-(trifluoromethoxy)phenyl]butanoate Traditional Name: 3-methyl-2-[4-(trifluoromethoxy)phenyl]butyric acid [cyano-(6-phenoxy-2-pyridyl)methyl] ester Formula: C25H21F3N2O4 MolecularWeight: 470.44045

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)OC(F)(F)F)C(=O)OC(C#N)C2=NC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)OC(F)(F)F)C(=O)OC(C#N)C2=NC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H21F3N2O4/c1-16(2)23(17-11-13-19(14-12-17)34-25(26,27)28)24(31)33-21(15-29)20-9-6-10-22(30-20)32-18-7-4-3-5-8-18/h3-14,16,21,23H,1-2H3