1-piperidin-1-yl-2-[4-[2-[4-(trifluoromethyl)phenyl]phenyl]carbonylpiperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-piperidin-1-yl-2-[4-[2-[4-(trifluoromethyl)phenyl]phenyl]carbonylpiperazin-1-ium-1-yl]ethanone Openeye Name: 1-(1-piperidyl)-2-[4-[2-[4-(trifluoromethyl)phenyl]benzoyl]piperazin-1-ium-1-yl]ethanone CAS Name: 2-[4-[oxo-[2-[4-(trifluoromethyl)phenyl]phenyl]methyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 1-piperidin-1-yl-2-[4-[2-[4-(trifluoromethyl)phenyl]benzoyl]piperazin-1-ium-1-yl]ethanone Traditional Name: 1-piperidino-2-[4-[2-[4-(trifluoromethyl)phenyl]benzoyl]piperazin-1-ium-1-yl]ethanone Formula: C25H29F3N3O2+ MolecularWeight: 460.51187

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C25H28F3N3O2/c26-25(27,28)20-10-8-19(9-11-20)21-6-2-3-7-22(21)24(33)31-16-14-29(15-17-31)18-23(32)30-12-4-1-5-13-30/h2-3,6-11H,1,4-5,12-18H2/p+1