methyl 3-pyridin-1-ium-1-ylcyclohex-3-ene-1-carboxylate hexafluorophosphate

Systemtic Name: methyl 3-pyridin-1-ium-1-ylcyclohex-3-ene-1-carboxylate hexafluorophosphate Openeye Name: methyl 3-pyridin-1-ium-1-ylcyclohex-3-ene-1-carboxylate hexafluorophosphate CAS Name: 3-(1-pyridin-1-iumyl)-1-cyclohex-3-enecarboxylic acid methyl ester hexafluorophosphate IUPAC Name: methyl 3-pyridin-1-ium-1-ylcyclohex-3-ene-1-carboxylate hexafluorophosphate Traditional Name: 3-pyridin-1-ium-1-ylcyclohex-3-ene-1-carboxylic acid methyl ester hexafluorophosphate Formula: C13H16F6NO2P MolecularWeight: 363.23582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC=C(C1)[N+]2=CC=CC=C2.F[P-](F)(F)(F)(F)F

Isomeric SMILES

COC(=O)C1CCC=C(C1)[N+]2=CC=CC=C2.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C13H16NO2.F6P/c1-16-13(15)11-6-5-7-12(10-11)14-8-3-2-4-9-14;1-7(2,3,4,5)6/h2-4,7-9,11H,5-6,10H2,1H3;/q+1;-1