2-pyridin-1-ium-1-ylethyl 3-(tridecylcarbamoyloxy)propyl phosphate

Systemtic Name: 2-pyridin-1-ium-1-ylethyl 3-(tridecylcarbamoyloxy)propyl phosphate Openeye Name: 2-pyridin-1-ium-1-ylethyl 3-(tridecylcarbamoyloxy)propyl phosphate CAS Name: 3-[oxo-(tridecylamino)methoxy]propyl 2-(1-pyridin-1-iumyl)ethyl phosphate IUPAC Name: 2-pyridin-1-ium-1-ylethyl 3-(tridecylcarbamoyloxy)propyl phosphate Traditional Name: 2-pyridin-1-ium-1-ylethyl 3-(tridecylcarbamoyloxy)propyl phosphate Formula: C24H43N2O6P MolecularWeight: 486.581781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCNC(=O)OCCCOP(=O)([O-])OCC[N+]1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCNC(=O)OCCCOP(=O)([O-])OCC[N+]1=CC=CC=C1

InChI

InChI=1S/C24H43N2O6P/c1-2-3-4-5-6-7-8-9-10-11-13-17-25-24(27)30-21-16-22-31-33(28,29)32-23-20-26-18-14-12-15-19-26/h12,14-15,18-19H,2-11,13,16-17,20-23H2,1H3,(H-,25,27,28,29)