N-[2-[3-[2,3-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-1-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]piperidin-4-amine

Systemtic Name: N-[2-[3-[2,3-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-1-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]piperidin-4-amine Openeye Name: N-[2-[1-benzyl-3-[2,3-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-piperazin-1-ium-1-yl]ethyl]piperidin-4-amine CAS Name: N-[2-[3-[2,3-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-1-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]-4-piperidinamine IUPAC Name: N-[2-[1-benzyl-3-[2,3-bis(trifluoromethyl)phenyl]-2-methyl-2-phenylpiperazin-1-ium-1-yl]ethyl]piperidin-4-amine Traditional Name: 2-[1-benzyl-3-[2,3-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-piperazin-1-ium-1-yl]ethyl-(4-piperidyl)amine Formula: C33H39F6N4+ MolecularWeight: 605.679979

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(NCC[N+]1(CCNC2CCNCC2)CC3=CC=CC=C3)C4=C(C(=CC=C4)C(F)(F)F)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

CC1(C(NCC[N+]1(CCNC2CCNCC2)CC3=CC=CC=C3)C4=C(C(=CC=C4)C(F)(F)F)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C33H39F6N4/c1-31(25-11-6-3-7-12-25)30(27-13-8-14-28(32(34,35)36)29(27)33(37,38)39)42-20-22-43(31,23-24-9-4-2-5-10-24)21-19-41-26-15-17-40-18-16-26/h2-14,26,30,40-42H,15-23H2,1H3/q+1