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

Systemtic Name: N-(2-adamantyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine hydrochloride Openeye Name: N-(2-adamantyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine hydrochloride CAS Name: N-(2-adamantyl)-4-[3-(trifluoromethyl)phenyl]-1-piperazinamine hydrochloride IUPAC Name: N-(2-adamantyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-amine hydrochloride Traditional Name: 2-adamantyl-[4-[3-(trifluoromethyl)phenyl]piperazino]amine hydrochloride Formula: C21H29ClF3N3 MolecularWeight: 415.92327

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)NC3C4CC5CC(C4)CC3C5.Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)NC3C4CC5CC(C4)CC3C5.Cl

InChI

InChI=1S/C21H28F3N3.ClH/c22-21(23,24)18-2-1-3-19(13-18)26-4-6-27(7-5-26)25-20-16-9-14-8-15(11-16)12-17(20)10-14;/h1-3,13-17,20,25H,4-12H2;1H