[2-methoxy-3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-propyl] N-octadecylcarbamate

Systemtic Name: [2-methoxy-3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-2-methoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[2-(1-pyridin-1-iumyl)ethoxy]phosphoryl]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-2-methoxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-2-methoxy-propyl] ester Formula: C30H56N2O7P+ MolecularWeight: 587.748601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(=O)(O)OCC[N+]1=CC=CC=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(=O)(O)OCC[N+]1=CC=CC=C1)OC

InChI

InChI=1S/C30H55N2O7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-31-30(33)37-27-29(36-2)28-39-40(34,35)38-26-25-32-23-20-18-21-24-32/h18,20-21,23-24,29H,3-17,19,22,25-28H2,1-2H3,(H-,31,33,34,35)/p+1