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3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tridecylcarbamate

3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tridecylcarbamate

Systemtic Name:3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tridecylcarbamate
Openeye Name:3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tridecylcarbamate
CAS Name:N-tridecylcarbamic acid 3-[hydroxy-[2-(1-pyridin-1-iumyl)ethoxy]phosphoryl]oxypropyl ester
IUPAC Name:3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tridecylcarbamate
Traditional Name:N-tridecylcarbamic acid 3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl ester
Formula: C24H44N2O6P+
MolecularWeight: 487.589721
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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)/p+1


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