2-(4-cyanophenyl)ethyl 4-[4-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: 2-(4-cyanophenyl)ethyl 4-[4-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: 2-(4-cyanophenyl)ethyl 4-[4-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[4-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxylic acid 2-(4-cyanophenyl)ethyl ester IUPAC Name: 2-(4-cyanophenyl)ethyl 4-[4-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylic acid 2-(4-cyanophenyl)ethyl ester Formula: C20H19F3N4O2 MolecularWeight: 404.38567

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C(F)(F)F)C(=O)OCCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C(F)(F)F)C(=O)OCCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19F3N4O2/c21-20(22,23)17-5-7-25-18(13-17)26-8-10-27(11-9-26)19(28)29-12-6-15-1-3-16(14-24)4-2-15/h1-5,7,13H,6,8-12H2