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

Systemtic Name: [2-methoxy-3-[oxidanyl-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-octadecylcarbamate Openeye Name: [3-[hydroxy-[4-(thiazol-3-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxy-propyl] N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [3-[hydroxy-[4-(3-thiazol-3-iumylmethyl)phenoxy]phosphino]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenoxy]phosphanyl]oxy-2-methoxypropyl] N-octadecylcarbamate Traditional Name: N-stearylcarbamic acid [3-[hydroxy-[4-(thiazol-3-ium-3-ylmethyl)phenoxy]phosphino]oxy-2-methoxy-propyl] ester Formula: C33H56N2O6PS+ MolecularWeight: 639.846301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H55N2O6PS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-34-33(36)39-27-32(38-2)28-40-42(37)41-31-21-19-30(20-22-31)26-35-24-25-43-29-35/h19-22,24-25,29,32,37H,3-18,23,26-28H2,1-2H3/p+1