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

Systemtic Name: [3-[oxidanyl-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-isopropoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[3-(1-quinolin-1-iumylmethyl)phenoxy]phosphino]oxy-2-propan-2-yloxypropyl] ester IUPAC Name: [3-[hydroxy-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[3-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphino]oxy-2-isopropoxy-propyl] ester Formula: C41H64N2O6P+ MolecularWeight: 711.930421

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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)OC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C41H63N2O6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-42-41(44)46-33-39(48-35(2)3)34-47-50(45)49-38-27-22-24-36(31-38)32-43-30-23-26-37-25-19-20-28-40(37)43/h19-20,22-28,30-31,35,39,45H,4-18,21,29,32-34H2,1-3H3/p+1