[(2R,3R,4R)-1,3,4-tris(phenylmethoxy)octadecan-2-yl] methanesulfonate

Systemtic Name: [(2R,3R,4R)-1,3,4-tris(phenylmethoxy)octadecan-2-yl] methanesulfonate Openeye Name: [(1R,2R,3R)-2,3-dibenzyloxy-1-(benzyloxymethyl)heptadecyl] methanesulfonate CAS Name: methanesulfonic acid [(2R,3R,4R)-1,3,4-tris(phenylmethoxy)octadecan-2-yl] ester IUPAC Name: [(2R,3R,4R)-1,3,4-tris(phenylmethoxy)octadecan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R,2R,3R)-2,3-dibenzoxy-1-(benzoxymethyl)heptadecyl] ester Formula: C40H58O6S MolecularWeight: 666.94992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(COCC1=CC=CC=C1)OS(=O)(=O)C)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCC[C@H]([C@H]([C@@H](COCC1=CC=CC=C1)OS(=O)(=O)C)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C40H58O6S/c1-3-4-5-6-7-8-9-10-11-12-13-23-30-38(44-32-36-26-19-15-20-27-36)40(45-33-37-28-21-16-22-29-37)39(46-47(2,41)42)34-43-31-35-24-17-14-18-25-35/h14-22,24-29,38-40H,3-13,23,30-34H2,1-2H3/t38-,39-,40-/m1/s1