[(E)-pent-2-en-4-ynyl] 4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: [(E)-pent-2-en-4-ynyl] 4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: [(E)-pent-2-en-4-ynyl] 4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxylic acid [(E)-pent-2-en-4-ynyl] ester IUPAC Name: [(E)-pent-2-en-4-ynyl] 4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylic acid [(E)-pent-2-en-4-ynyl] ester Formula: C16H16F3N3O2 MolecularWeight: 339.31235

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Descriptors Computed from Structure

Canonical SMILES:

C#CC=CCOC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C#C/C=C/COC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O2/c1-2-3-4-11-24-15(23)22-9-7-21(8-10-22)14-6-5-13(12-20-14)16(17,18)19/h1,3-6,12H,7-11H2/b4-3+