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

Systemtic Name: [1-octadecoxy-3-[oxidanyl(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxy-propan-2-yl] N,N-dimethylcarbamate Openeye Name: [1-[[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxymethyl]-2-octadecoxy-ethyl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic 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,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [1-[[hydroxy(2-pyridin-1-ium-1-ylethoxy)phosphoryl]oxymethyl]-2-stearyloxy-ethyl] ester Formula: C31H58N2O7P+ MolecularWeight: 601.775181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H57N2O7P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-26-37-28-30(40-31(34)32(2)3)29-39-41(35,36)38-27-25-33-23-20-19-21-24-33/h19-21,23-24,30H,4-18,22,25-29H2,1-3H3/p+1