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

Systemtic Name: [3-[oxidanyl-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-isopropoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[3-(1-pyridin-1-iumylmethyl)phenoxy]phosphino]oxy-2-propan-2-yloxypropyl] ester IUPAC Name: [3-[hydroxy-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphino]oxy-2-isopropoxy-propyl] ester Formula: C37H62N2O6P+ MolecularWeight: 661.871741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H61N2O6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-26-38-37(40)42-31-36(44-33(2)3)32-43-46(41)45-35-25-23-24-34(29-35)30-39-27-21-19-22-28-39/h19,21-25,27-29,33,36,41H,4-18,20,26,30-32H2,1-3H3/p+1