[(2R)-2-methoxy-3-(octadecylcarbamoyloxy)propyl] 2-(1,3-thiazol-3-ium-3-yl)ethyl phosphate

Systemtic Name: [(2R)-2-methoxy-3-(octadecylcarbamoyloxy)propyl] 2-(1,3-thiazol-3-ium-3-yl)ethyl phosphate Openeye Name: [(2R)-2-methoxy-3-(octadecylcarbamoyloxy)propyl] 2-thiazol-3-ium-3-ylethyl phosphate CAS Name: [(2R)-2-methoxy-3-[(octadecylamino)-oxomethoxy]propyl] 2-(3-thiazol-3-iumyl)ethyl phosphate IUPAC Name: [(2R)-2-methoxy-3-(octadecylcarbamoyloxy)propyl] 2-(1,3-thiazol-3-ium-3-yl)ethyl phosphate Traditional Name: [(2R)-2-methoxy-3-(stearylcarbamoyloxy)propyl] 2-thiazol-3-ium-3-ylethyl phosphate Formula: C28H53N2O7PS MolecularWeight: 592.768381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COP(=O)([O-])OCC[N+]1=CSC=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OC[C@H](COP(=O)([O-])OCC[N+]1=CSC=C1)OC

InChI

InChI=1S/C28H53N2O7PS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-29-28(31)35-24-27(34-2)25-37-38(32,33)36-22-20-30-21-23-39-26-30/h21,23,26-27H,3-20,22,24-25H2,1-2H3,(H-,29,31,32,33)/t27-/m1/s1