N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine

Systemtic Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine Openeye Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine CAS Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]-1-piperazinamine IUPAC Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine Traditional Name: 2-adamantylmethyl-[4-[3-(trifluoromethyl)phenyl]piperazino]amine Formula: C22H30F3N3 MolecularWeight: 393.48891

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)NCC3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)NCC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H30F3N3/c23-22(24,25)19-2-1-3-20(13-19)27-4-6-28(7-5-27)26-14-21-17-9-15-8-16(11-17)12-18(21)10-15/h1-3,13,15-18,21,26H,4-12,14H2