1-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-4-[4-(trifluoromethyl)pyridin-2-yl]piperazine

Systemtic Name: 1-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-4-[4-(trifluoromethyl)pyridin-2-yl]piperazine Openeye Name: 1-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-4-[4-(trifluoromethyl)-2-pyridyl]piperazine CAS Name: 1-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-4-[4-(trifluoromethyl)-2-pyridinyl]piperazine IUPAC Name: 1-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-4-[4-(trifluoromethyl)pyridin-2-yl]piperazine Traditional Name: 1-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-4-[4-(trifluoromethyl)-2-pyridyl]piperazine Formula: C20H21F3N5+ MolecularWeight: 388.40945

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C[NH+]=C(N2)C3=CC=CC=C3)C4=NC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=C[NH+]=C(N2)C3=CC=CC=C3)C4=NC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H20F3N5/c21-20(22,23)16-6-7-24-18(12-16)28-10-8-27(9-11-28)14-17-13-25-19(26-17)15-4-2-1-3-5-15/h1-7,12-13H,8-11,14H2,(H,25,26)/p+1