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

Systemtic Name: [2-methoxy-3-[oxidanyl-[2-(1,3-thiazol-3-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[2-(thiazol-3-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[2-(3-thiazol-3-iumylmethyl)phenoxy]phosphino]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy-[2-(1,3-thiazol-3-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[2-(thiazol-3-ium-3-ylmethyl)phenoxy]phosphino]oxy-2-methoxy-propyl] ester Formula: C33H56N2O6PS+ MolecularWeight: 639.846301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC=C1C[N+]2=CSC=C2)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC=C1C[N+]2=CSC=C2)OC

InChI

InChI=1S/C33H55N2O6PS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-34-33(36)39-27-31(38-2)28-40-42(37)41-32-22-19-18-21-30(32)26-35-24-25-43-29-35/h18-19,21-22,24-25,29,31,37H,3-17,20,23,26-28H2,1-2H3/p+1