(4-cyanophenyl)methyl 2-[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoate Openeye Name: (4-cyanophenyl)methyl 2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridyl]acetate CAS Name: 2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetate Traditional Name: 2-[3-chloro-2-keto-5-(trifluoromethyl)-1-pyridyl]acetic acid (4-cyanobenzyl) ester Formula: C16H10ClF3N2O3 MolecularWeight: 370.71041

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CN2C=C(C=C(C2=O)Cl)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CN2C=C(C=C(C2=O)Cl)C(F)(F)F)C#N

InChI

InChI=1S/C16H10ClF3N2O3/c17-13-5-12(16(18,19)20)7-22(15(13)24)8-14(23)25-9-11-3-1-10(6-21)2-4-11/h1-5,7H,8-9H2