[(2S)-1-octadecoxy-3-phenylmethoxy-propan-2-yl] octadecanoate

Systemtic Name: [(2S)-1-octadecoxy-3-phenylmethoxy-propan-2-yl] octadecanoate Openeye Name: [(1S)-1-(benzyloxymethyl)-2-octadecoxy-ethyl] octadecanoate CAS Name: octadecanoic acid [(2S)-1-octadecoxy-3-phenylmethoxypropan-2-yl] ester IUPAC Name: [(2S)-1-octadecoxy-3-phenylmethoxypropan-2-yl] octadecanoate Traditional Name: stearic acid [(1S)-1-(benzoxymethyl)-2-stearyloxy-ethyl] ester Formula: C46H84O4 MolecularWeight: 701.15676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@@H](COCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C46H84O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36-40-48-42-45(43-49-41-44-37-33-32-34-38-44)50-46(47)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,37-38,45H,3-31,35-36,39-43H2,1-2H3/t45-/m0/s1