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

Systemtic Name: 1-ethyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Openeye Name: 1-ethyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium CAS Name: 1-ethyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-ethyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Traditional Name: 1-ethyl-4-[3-(trifluoromethyl)benzyl]piperazine-1,4-diium Formula: C14H21F3N2+2 MolecularWeight: 274.32515

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H19F3N2/c1-2-18-6-8-19(9-7-18)11-12-4-3-5-13(10-12)14(15,16)17/h3-5,10H,2,6-9,11H2,1H3/p+2