[1-[2-azanylethoxy(prop-2-enoxy)phosphoryl]oxy-2-(tetradecanoylamino)tetradecan-4-yl] pentadecanoate

Systemtic Name: [1-[2-azanylethoxy(prop-2-enoxy)phosphoryl]oxy-2-(tetradecanoylamino)tetradecan-4-yl] pentadecanoate Openeye Name: 1-[3-[allyloxy(2-aminoethoxy)phosphoryl]oxy-2-(tetradecanoylamino)propyl]undecyl pentadecanoate CAS Name: pentadecanoic acid [1-[2-aminoethoxy(prop-2-enoxy)phosphoryl]oxy-2-(1-oxotetradecylamino)tetradecan-4-yl] ester IUPAC Name: [1-[2-aminoethoxy(prop-2-enoxy)phosphoryl]oxy-2-(tetradecanoylamino)tetradecan-4-yl] pentadecanoate Traditional Name: pentadecanoic acid 1-[3-[allyloxy(2-aminoethoxy)phosphoryl]oxy-2-(tetradecanoylamino)propyl]undecyl ester Formula: C48H95N2O7P MolecularWeight: 843.250861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCC)CC(COP(=O)(OCCN)OCC=C)NC(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCC)CC(COP(=O)(OCCN)OCC=C)NC(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C48H95N2O7P/c1-5-9-12-15-18-21-23-25-27-30-33-36-39-48(52)57-46(37-34-31-28-20-17-14-11-7-3)43-45(44-56-58(53,54-41-8-4)55-42-40-49)50-47(51)38-35-32-29-26-24-22-19-16-13-10-6-2/h8,45-46H,4-7,9-44,49H2,1-3H3,(H,50,51)