[(2R,3R,4S,5S,6R)-6-[(1R,2R,3S,4S,5R,6R)-1,2,3,4,5,6,7-heptakis(phenylmethoxy)heptyl]-3,4,5-tris(phenylmethoxy)oxan-2-yl] ethanoate

Systemtic Name: [(2R,3R,4S,5S,6R)-6-[(1R,2R,3S,4S,5R,6R)-1,2,3,4,5,6,7-heptakis(phenylmethoxy)heptyl]-3,4,5-tris(phenylmethoxy)oxan-2-yl] ethanoate Openeye Name: [(2R,3R,4S,5S,6R)-3,4,5-tribenzyloxy-6-[(1R,2R,3S,4S,5R,6R)-1,2,3,4,5,6,7-heptabenzyloxyheptyl]tetrahydropyran-2-yl] acetate CAS Name: acetic acid [(2R,3R,4S,5S,6R)-6-[(1R,2R,3S,4S,5R,6R)-1,2,3,4,5,6,7-heptakis(phenylmethoxy)heptyl]-3,4,5-tris(phenylmethoxy)-2-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6R)-6-[(1R,2R,3S,4S,5R,6R)-1,2,3,4,5,6,7-heptakis(phenylmethoxy)heptyl]-3,4,5-tris(phenylmethoxy)oxan-2-yl] acetate Traditional Name: acetic acid [(2R,3R,4S,5S,6R)-3,4,5-tribenzoxy-6-[(1R,2R,3S,4S,5R,6R)-1,2,3,4,5,6,7-heptabenzoxyheptyl]tetrahydropyran-2-yl] ester Formula: C84H86O13 MolecularWeight: 1303.57384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(C(O1)C(C(C(C(C(C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

Isomeric SMILES

CC(=O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)[C@@H]([C@@H]([C@H]([C@H]([C@@H]([C@@H](COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

InChI

InChI=1S/C84H86O13/c1-63(85)96-84-83(95-61-73-50-30-11-31-51-73)81(94-60-72-48-28-10-29-49-72)80(93-59-71-46-26-9-27-47-71)82(97-84)79(92-58-70-44-24-8-25-45-70)78(91-57-69-42-22-7-23-43-69)77(90-56-68-40-20-6-21-41-68)76(89-55-67-38-18-5-19-39-67)75(88-54-66-36-16-4-17-37-66)74(87-53-65-34-14-3-15-35-65)62-86-52-64-32-12-2-13-33-64/h2-51,74-84H,52-62H2,1H3/t74-,75-,76+,77+,78-,79-,80+,81+,82-,83-,84+/m1/s1