2-(4-bromophenyl)ethyl 4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: 2-(4-bromophenyl)ethyl 4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: 2-(4-bromophenyl)ethyl 4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxylic acid 2-(4-bromophenyl)ethyl ester IUPAC Name: 2-(4-bromophenyl)ethyl 4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylic acid 2-(4-bromophenyl)ethyl ester Formula: C19H19BrF3N3O2 MolecularWeight: 458.27227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrF3N3O2/c20-16-4-1-14(2-5-16)7-12-28-18(27)26-10-8-25(9-11-26)17-6-3-15(13-24-17)19(21,22)23/h1-6,13H,7-12H2