[2-methoxy-3-[oxidanyl-[3-(pyridin-1-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate

Systemtic Name: [2-methoxy-3-[oxidanyl-[3-(pyridin-1-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[3-(pyridin-1-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[3-(3-pyridin-1-iumylmethyl)phenoxy]phosphino]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy-[3-(pyridin-1-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[3-(pyridin-1-ium-3-ylmethyl)phenoxy]phosphino]oxy-2-methoxy-propyl] ester Formula: C35H58N2O6P+ MolecularWeight: 633.818581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC(=C1)CC2=C[NH+]=CC=C2)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC(=C1)CC2=C[NH+]=CC=C2)OC

InChI

InChI=1S/C35H57N2O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-37-35(38)41-29-34(40-2)30-42-44(39)43-33-23-19-21-31(27-33)26-32-22-20-24-36-28-32/h19-24,27-28,34,39H,3-18,25-26,29-30H2,1-2H3,(H,37,38)/p+1