3-[2-[[2-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxyethyl]-1,3-thiazol-3-ium-4-olate

Systemtic Name: 3-[2-[[2-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxyethyl]-1,3-thiazol-3-ium-4-olate Openeye Name: 3-[2-[hydroxy-[[2-(octadecylcarbamoyloxymethyl)tetrahydrofuran-2-yl]methoxy]phosphoryl]oxyethyl]thiazol-3-ium-4-olate CAS Name: 3-[2-[hydroxy-[[2-[[(octadecylamino)-oxomethoxy]methyl]-2-oxolanyl]methoxy]phosphoryl]oxyethyl]-4-thiazol-3-iumolate IUPAC Name: 3-[2-[hydroxy-[[2-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methoxy]phosphoryl]oxyethyl]-1,3-thiazol-3-ium-4-olate Traditional Name: 3-[2-[hydroxy-[[2-(stearylcarbamoyloxymethyl)tetrahydrofuran-2-yl]methoxy]phosphoryl]oxyethyl]thiazol-3-ium-4-olate Formula: C30H55N2O8PS MolecularWeight: 634.805061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCCO1)COP(=O)(O)OCC[N+]2=CSC=C2[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCCO1)COP(=O)(O)OCC[N+]2=CSC=C2[O-]

InChI

InChI=1S/C30H55N2O8PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-31-29(34)37-25-30(19-18-22-38-30)26-40-41(35,36)39-23-21-32-27-42-24-28(32)33/h24,27H,2-23,25-26H2,1H3,(H2-,31,33,34,35,36)