[6-[4-chloranyl-2-(trifluoromethyl)phenoxy]pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate

Systemtic Name: [6-[4-chloranyl-2-(trifluoromethyl)phenoxy]pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate Openeye Name: [6-[4-chloro-2-(trifluoromethyl)phenoxy]-2-pyridyl]methyl 2-cyano-3-methyl-2-(2-naphthyl)butanoate CAS Name: 2-cyano-3-methyl-2-(2-naphthalenyl)butanoic acid [6-[4-chloro-2-(trifluoromethyl)phenoxy]-2-pyridinyl]methyl ester IUPAC Name: [6-[4-chloro-2-(trifluoromethyl)phenoxy]pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-ylbutanoate Traditional Name: 2-cyano-3-methyl-2-(2-naphthyl)butyric acid [6-[4-chloro-2-(trifluoromethyl)phenoxy]-2-pyridyl]methyl ester Formula: C29H22ClF3N2O3 MolecularWeight: 538.94479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)(C1=CC2=CC=CC=C2C=C1)C(=O)OCC3=NC(=CC=C3)OC4=C(C=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

CC(C)C(C#N)(C1=CC2=CC=CC=C2C=C1)C(=O)OCC3=NC(=CC=C3)OC4=C(C=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C29H22ClF3N2O3/c1-18(2)28(17-34,21-11-10-19-6-3-4-7-20(19)14-21)27(36)37-16-23-8-5-9-26(35-23)38-25-13-12-22(30)15-24(25)29(31,32)33/h3-15,18H,16H2,1-2H3