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

Systemtic Name: [6-(4-methoxyphenoxy)pyridin-2-yl]methyl 2-[[2-chloranyl-4-(trifluoromethyl)phenyl]amino]-2-cyano-3-methyl-butanoate Openeye Name: [6-(4-methoxyphenoxy)-2-pyridyl]methyl 2-[2-chloro-4-(trifluoromethyl)anilino]-2-cyano-3-methyl-butanoate CAS Name: 2-[2-chloro-4-(trifluoromethyl)anilino]-2-cyano-3-methylbutanoic acid [6-(4-methoxyphenoxy)-2-pyridinyl]methyl ester IUPAC Name: [6-(4-methoxyphenoxy)pyridin-2-yl]methyl 2-[2-chloro-4-(trifluoromethyl)anilino]-2-cyano-3-methylbutanoate Traditional Name: 2-[2-chloro-4-(trifluoromethyl)anilino]-2-cyano-3-methyl-butyric acid [6-(4-methoxyphenoxy)-2-pyridyl]methyl ester Formula: C26H23ClF3N3O4 MolecularWeight: 533.92673

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)(C(=O)OCC1=NC(=CC=C1)OC2=CC=C(C=C2)OC)NC3=C(C=C(C=C3)C(F)(F)F)Cl

Isomeric SMILES

CC(C)C(C#N)(C(=O)OCC1=NC(=CC=C1)OC2=CC=C(C=C2)OC)NC3=C(C=C(C=C3)C(F)(F)F)Cl

InChI

InChI=1S/C26H23ClF3N3O4/c1-16(2)25(15-31,33-22-12-7-17(13-21(22)27)26(28,29)30)24(34)36-14-18-5-4-6-23(32-18)37-20-10-8-19(35-3)9-11-20/h4-13,16,33H,14H2,1-3H3