1-(8-azabicyclo[3.2.1]octan-8-yl)-2-phenyl-4-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]butan-1-one

Systemtic Name: 1-(8-azabicyclo[3.2.1]octan-8-yl)-2-phenyl-4-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]butan-1-one Openeye Name: 1-(8-azabicyclo[3.2.1]octan-8-yl)-2-phenyl-4-[4-[3-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]butan-1-one CAS Name: 1-(8-azabicyclo[3.2.1]octan-8-yl)-2-phenyl-4-[4-[3-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-(8-azabicyclo[3.2.1]octan-8-yl)-2-phenyl-4-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]butan-1-one Traditional Name: 1-(8-azabicyclo[3.2.1]octan-8-yl)-2-phenyl-4-[4-[3-(trifluoromethyl)-2-pyridyl]piperazino]butan-1-one Formula: C27H33F3N4O MolecularWeight: 486.57233

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC(C1)N2C(=O)C(CCN3CCN(CC3)C4=C(C=CC=N4)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

C1CC2CCC(C1)N2C(=O)C(CCN3CCN(CC3)C4=C(C=CC=N4)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C27H33F3N4O/c28-27(29,30)24-10-5-14-31-25(24)33-18-16-32(17-19-33)15-13-23(20-6-2-1-3-7-20)26(35)34-21-8-4-9-22(34)12-11-21/h1-3,5-7,10,14,21-23H,4,8-9,11-13,15-19H2