[1-octadecoxy-3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-propan-2-yl] N-methylcarbamate

Systemtic Name: [1-octadecoxy-3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-propan-2-yl] N-methylcarbamate Openeye Name: [1-[[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxymethyl]-2-octadecoxy-ethyl] N-methylcarbamate CAS Name: N-methylcarbamic acid [1-[hydroxy-[2-(1-pyridin-1-iumyl)ethoxy]phosphoryl]oxy-3-octadecoxypropan-2-yl] ester IUPAC Name: [1-[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-3-octadecoxypropan-2-yl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [1-[[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxymethyl]-2-stearyloxy-ethyl] ester Formula: C30H56N2O7P+ MolecularWeight: 587.748601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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