2-pyridin-1-ium-1-ylethyl (4-tetradecyloxolan-2-yl)methyl phosphate

Systemtic Name: 2-pyridin-1-ium-1-ylethyl (4-tetradecyloxolan-2-yl)methyl phosphate Openeye Name: 2-pyridin-1-ium-1-ylethyl (4-tetradecyltetrahydrofuran-2-yl)methyl phosphate CAS Name: 2-(1-pyridin-1-iumyl)ethyl (4-tetradecyl-2-oxolanyl)methyl phosphate IUPAC Name: 2-pyridin-1-ium-1-ylethyl (4-tetradecyloxolan-2-yl)methyl phosphate Traditional Name: (4-myristyltetrahydrofuran-2-yl)methyl 2-pyridin-1-ium-1-ylethyl phosphate Formula: C26H46NO5P MolecularWeight: 483.620901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1CC(OC1)COP(=O)([O-])OCC[N+]2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC1CC(OC1)COP(=O)([O-])OCC[N+]2=CC=CC=C2

InChI

InChI=1S/C26H46NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-25-22-26(30-23-25)24-32-33(28,29)31-21-20-27-18-15-13-16-19-27/h13,15-16,18-19,25-26H,2-12,14,17,20-24H2,1H3