(6-phenoxypyridin-2-yl)methyl (E)-2-cyano-2-propan-2-yl-4-[2-(trifluoromethyl)phenyl]but-3-enoate

Systemtic Name: (6-phenoxypyridin-2-yl)methyl (E)-2-cyano-2-propan-2-yl-4-[2-(trifluoromethyl)phenyl]but-3-enoate Openeye Name: (6-phenoxy-2-pyridyl)methyl (E)-2-cyano-2-isopropyl-4-[2-(trifluoromethyl)phenyl]but-3-enoate CAS Name: (E)-2-cyano-2-propan-2-yl-4-[2-(trifluoromethyl)phenyl]-3-butenoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl (E)-2-cyano-2-propan-2-yl-4-[2-(trifluoromethyl)phenyl]but-3-enoate Traditional Name: (E)-2-cyano-2-isopropyl-4-[2-(trifluoromethyl)phenyl]but-3-enoic acid (6-phenoxy-2-pyridyl)methyl ester Formula: C27H23F3N2O3 MolecularWeight: 480.47833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=CC1=CC=CC=C1C(F)(F)F)(C#N)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)C(/C=C/C1=CC=CC=C1C(F)(F)F)(C#N)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C27H23F3N2O3/c1-19(2)26(18-31,16-15-20-9-6-7-13-23(20)27(28,29)30)25(33)34-17-21-10-8-14-24(32-21)35-22-11-4-3-5-12-22/h3-16,19H,17H2,1-2H3/b16-15+