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

Systemtic Name: 3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tetradecylcarbamate Openeye Name: 3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl N-tetradecylcarbamate CAS Name: N-tetradecylcarbamic 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-tetradecylcarbamate Traditional Name: N-myristylcarbamic acid 3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxypropyl ester Formula: C25H46N2O6P+ MolecularWeight: 501.616301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H45N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-14-18-26-25(28)31-22-17-23-32-34(29,30)33-24-21-27-19-15-13-16-20-27/h13,15-16,19-20H,2-12,14,17-18,21-24H2,1H3,(H-,26,28,29,30)/p+1