2,3-dihydro-1H-inden-5-yl-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1H-inden-5-yl-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone Openeye Name: indan-5-yl-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1H-inden-5-yl-[4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1H-inden-5-yl-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone Traditional Name: indan-5-yl-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazino]methanone Formula: C20H21F3N3O+ MolecularWeight: 376.39545

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)N3CCN(CC3)C4=[NH+]C=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)N3CCN(CC3)C4=[NH+]C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O/c21-20(22,23)17-6-7-18(24-13-17)25-8-10-26(11-9-25)19(27)16-5-4-14-2-1-3-15(14)12-16/h4-7,12-13H,1-3,8-11H2/p+1