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

Systemtic Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine hydrochloride Openeye Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine hydrochloride CAS Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]-1-piperazinamine hydrochloride IUPAC Name: N-(2-adamantylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine hydrochloride Traditional Name: 2-adamantylmethyl-[4-[3-(trifluoromethyl)phenyl]piperazino]amine hydrochloride Formula: C22H31ClF3N3 MolecularWeight: 429.94985

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30F3N3.ClH/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;1H