1-[2-(2,4-dimethyl-6-tetradecyl-pyridin-1-ium-1-yl)ethyl]-2,4-dimethyl-6-tetradecyl-pyridin-1-ium dihexafluorophosphate

Systemtic Name: 1-[2-(2,4-dimethyl-6-tetradecyl-pyridin-1-ium-1-yl)ethyl]-2,4-dimethyl-6-tetradecyl-pyridin-1-ium dihexafluorophosphate Openeye Name: 1-[2-(2,4-dimethyl-6-tetradecyl-pyridin-1-ium-1-yl)ethyl]-2,4-dimethyl-6-tetradecyl-pyridin-1-ium dihexafluorophosphate CAS Name: 1-[2-(2,4-dimethyl-6-tetradecyl-1-pyridin-1-iumyl)ethyl]-2,4-dimethyl-6-tetradecylpyridin-1-ium dihexafluorophosphate IUPAC Name: 1-[2-(2,4-dimethyl-6-tetradecylpyridin-1-ium-1-yl)ethyl]-2,4-dimethyl-6-tetradecylpyridin-1-ium dihexafluorophosphate Traditional Name: 1-[2-(2,4-dimethyl-6-myristyl-pyridin-1-ium-1-yl)ethyl]-2,4-dimethyl-6-myristyl-pyridin-1-ium dihexafluorophosphate Formula: C44H78F12N2P2 MolecularWeight: 925.03188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC(=CC(=[N+]1CC[N+]2=C(C=C(C=C2CCCCCCCCCCCCCC)C)C)C)C.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC(=CC(=[N+]1CC[N+]2=C(C=C(C=C2CCCCCCCCCCCCCC)C)C)C)C.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C44H78N2.2F6P/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-43-37-39(3)35-41(5)45(43)33-34-46-42(6)36-40(4)38-44(46)32-30-28-26-24-22-20-18-16-14-12-10-8-2;2*1-7(2,3,4,5)6/h35-38H,7-34H2,1-6H3;;/q+2;2*-1