[2-methoxy-3-[oxidanyl-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate

Systemtic Name: [2-methoxy-3-[oxidanyl-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[4-(1-pyridin-1-iumylmethyl)phenoxy]phosphino]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[4-(pyridin-1-ium-1-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=C(C=C1)C[N+]2=CC=CC=C2)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=C(C=C1)C[N+]2=CC=CC=C2)OC

InChI

InChI=1S/C35H57N2O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-26-36-35(38)41-30-34(40-2)31-42-44(39)43-33-24-22-32(23-25-33)29-37-27-20-18-21-28-37/h18,20-25,27-28,34,39H,3-17,19,26,29-31H2,1-2H3/p+1