1-(naphthalen-2-ylmethyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium

Systemtic Name: 1-(naphthalen-2-ylmethyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Openeye Name: 1-(2-naphthylmethyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium CAS Name: 1-(2-naphthalenylmethyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-(naphthalen-2-ylmethyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Traditional Name: 1-(2-naphthylmethyl)-4-[4-(trifluoromethyl)benzyl]piperazine-1,4-diium Formula: C23H25F3N2+2 MolecularWeight: 386.45321

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)C(F)(F)F)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)C(F)(F)F)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H23F3N2/c24-23(25,26)22-9-6-18(7-10-22)16-27-11-13-28(14-12-27)17-19-5-8-20-3-1-2-4-21(20)15-19/h1-10,15H,11-14,16-17H2/p+2