[1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-nonanoyloxy-propan-2-yl] tridecanoate

Systemtic Name: [1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-nonanoyloxy-propan-2-yl] tridecanoate Openeye Name: [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-nonanoyloxy-ethyl] tridecanoate CAS Name: tridecanoic acid [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-(1-oxononoxy)propan-2-yl] ester IUPAC Name: [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-nonanoyloxypropan-2-yl] tridecanoate Traditional Name: tridecanoic acid [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-pelargonyloxy-ethyl] ester Formula: C27H54NO8P MolecularWeight: 551.693321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC)COP(=O)(O)OCCN

Isomeric SMILES

CCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC)COP(=O)(O)OCCN

InChI

InChI=1S/C27H54NO8P/c1-3-5-7-9-11-12-13-14-16-18-20-27(30)36-25(24-35-37(31,32)34-22-21-28)23-33-26(29)19-17-15-10-8-6-4-2/h25H,3-24,28H2,1-2H3,(H,31,32)