N-[2-[3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-1-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]piperidin-4-amine

Systemtic Name: N-[2-[3-[3,5-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-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-piperazin-1-ium-1-yl]ethyl]piperidin-4-amine CAS Name: N-[2-[3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-2-phenyl-1-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]-4-piperidinamine IUPAC Name: N-[2-[1-benzyl-3-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-2-phenylpiperazin-1-ium-1-yl]ethyl]piperidin-4-amine Traditional Name: 2-[1-benzyl-3-[3,5-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=CC(=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=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C5=CC=CC=C5

InChI

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