propyl 1-[3-[2,5-bis(fluoranyl)phenyl]prop-2-ynyl]piperidine-3-carboxylate

Systemtic Name: propyl 1-[3-[2,5-bis(fluoranyl)phenyl]prop-2-ynyl]piperidine-3-carboxylate Openeye Name: propyl 1-[3-(2,5-difluorophenyl)prop-2-ynyl]piperidine-3-carboxylate CAS Name: 1-[3-(2,5-difluorophenyl)prop-2-ynyl]-3-piperidinecarboxylic acid propyl ester IUPAC Name: propyl 1-[3-(2,5-difluorophenyl)prop-2-ynyl]piperidine-3-carboxylate Traditional Name: 1-[3-(2,5-difluorophenyl)prop-2-ynyl]nipecotic acid propyl ester Formula: C18H21F2NO2 MolecularWeight: 321.361646

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1CCCN(C1)CC#CC2=C(C=CC(=C2)F)F

Isomeric SMILES

CCCOC(=O)C1CCCN(C1)CC#CC2=C(C=CC(=C2)F)F

InChI

InChI=1S/C18H21F2NO2/c1-2-11-23-18(22)15-6-4-10-21(13-15)9-3-5-14-12-16(19)7-8-17(14)20/h7-8,12,15H,2,4,6,9-11,13H2,1H3