[(2R)-1-[[di(propan-2-yl)amino]-phenylmethoxy-phosphanyl]oxy-3-octadecoxy-propan-2-yl] octadecanoate

Systemtic Name: [(2R)-1-[[di(propan-2-yl)amino]-phenylmethoxy-phosphanyl]oxy-3-octadecoxy-propan-2-yl] octadecanoate Openeye Name: [(1R)-1-[[benzyloxy-(diisopropylamino)phosphanyl]oxymethyl]-2-octadecoxy-ethyl] octadecanoate CAS Name: octadecanoic acid [(2R)-1-[[di(propan-2-yl)amino]-phenylmethoxyphosphino]oxy-3-octadecoxypropan-2-yl] ester IUPAC Name: [(2R)-1-[[di(propan-2-yl)amino]-phenylmethoxyphosphanyl]oxy-3-octadecoxypropan-2-yl] octadecanoate Traditional Name: stearic acid [(1R)-1-[[benzoxy-(diisopropylamino)phosphino]oxymethyl]-2-stearyloxy-ethyl] ester Formula: C52H98NO5P MolecularWeight: 848.311981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(N(C(C)C)C(C)C)OCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@H](COP(N(C(C)C)C(C)C)OCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C52H98NO5P/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40-44-55-46-51(47-57-59(53(48(3)4)49(5)6)56-45-50-41-37-36-38-42-50)58-52(54)43-39-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h36-38,41-42,48-49,51H,7-35,39-40,43-47H2,1-6H3/t51-,59?/m1/s1