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

Systemtic Name: [2-ethoxy-3-[oxidanyl-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate Openeye Name: [2-ethoxy-3-[hydroxy-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [2-ethoxy-3-[hydroxy-[3-(1-quinolin-1-iumylmethyl)phenoxy]phosphino]oxypropyl] ester IUPAC Name: [2-ethoxy-3-[hydroxy-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [2-ethoxy-3-[hydroxy-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphino]oxy-propyl] ester Formula: C40H62N2O6P+ MolecularWeight: 697.903841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC(=C1)C[N+]2=CC=CC3=CC=CC=C32)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC(=C1)C[N+]2=CC=CC3=CC=CC=C32)OCC

InChI

InChI=1S/C40H61N2O6P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-41-40(43)46-33-38(45-4-2)34-47-49(44)48-37-27-22-24-35(31-37)32-42-30-23-26-36-25-19-20-28-39(36)42/h19-20,22-28,30-31,38,44H,3-18,21,29,32-34H2,1-2H3/p+1