[3-[2-dimethylaminoethyloxy(oxidanyl)phosphoryl]oxy-2-icosanoyloxy-propyl] icosanoate

Systemtic Name: [3-[2-dimethylaminoethyloxy(oxidanyl)phosphoryl]oxy-2-icosanoyloxy-propyl] icosanoate Openeye Name: [3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-icosanoyloxy-propyl] icosanoate CAS Name: eicosanoic acid [3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-(1-oxoeicosoxy)propyl] ester IUPAC Name: [3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-icosanoyloxypropyl] icosanoate Traditional Name: arachidic acid [3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-eicosanoyloxy-propyl] ester Formula: C47H94NO8P MolecularWeight: 832.224921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C47H94NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-46(49)53-43-45(44-55-57(51,52)54-42-41-48(3)4)56-47(50)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h45H,5-44H2,1-4H3,(H,51,52)