1-methyl-4-[2-[3-(trifluoromethyl)phenoxy]ethyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[2-[3-(trifluoromethyl)phenoxy]ethyl]piperazine-1,4-diium Openeye Name: 1-methyl-4-[2-[3-(trifluoromethyl)phenoxy]ethyl]piperazine-1,4-diium CAS Name: 1-methyl-4-[2-[3-(trifluoromethyl)phenoxy]ethyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[2-[3-(trifluoromethyl)phenoxy]ethyl]piperazine-1,4-diium Traditional Name: 1-methyl-4-[2-[3-(trifluoromethyl)phenoxy]ethyl]piperazine-1,4-diium Formula: C14H21F3N2O+2 MolecularWeight: 290.32455

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCOC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCOC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H19F3N2O/c1-18-5-7-19(8-6-18)9-10-20-13-4-2-3-12(11-13)14(15,16)17/h2-4,11H,5-10H2,1H3/p+2