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

Systemtic Name: [2-methoxy-3-[oxidanyl-[4-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[4-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[4-(1-quinolin-1-iumylmethyl)phenoxy]phosphino]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy-[4-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[4-(quinolin-1-ium-1-ylmethyl)phenoxy]phosphino]oxy-2-methoxy-propyl] ester Formula: C39H60N2O6P+ MolecularWeight: 683.877261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C39H59N2O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29-40-39(42)45-32-37(44-2)33-46-48(43)47-36-27-25-34(26-28-36)31-41-30-21-23-35-22-18-19-24-38(35)41/h18-19,21-28,30,37,43H,3-17,20,29,31-33H2,1-2H3/p+1