[2-(4-phenylpiperidin-1-yl)-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: [2-(4-phenylpiperidin-1-yl)-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: [2-(4-phenyl-1-piperidyl)-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: [2-(4-phenyl-1-piperidinyl)-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: [2-(4-phenylpiperidin-1-yl)-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [2-(4-phenylpiperidino)-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C31H38F3N3O MolecularWeight: 525.64813

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC2(C1)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)N5CCC(CC5)C6=CC=CC=C6

Isomeric SMILES

C1CC2CC(CC2(C1)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)N5CCC(CC5)C6=CC=CC=C6

InChI

InChI=1S/C31H38F3N3O/c32-31(33,34)26-8-4-10-27(21-26)36-16-18-37(19-17-36)29(38)30-13-5-9-25(30)20-28(22-30)35-14-11-24(12-15-35)23-6-2-1-3-7-23/h1-4,6-8,10,21,24-25,28H,5,9,11-20,22H2