1-[[3-[(3-ethyl-5-octyl-2-oxidanyl-phenyl)methyl]-5-octyl-2-oxidanyl-phenyl]methyl]-9-methyl-3,7-dioctyl-5H-benzo[d][1,3]benzodioxocin-11-one

Systemtic Name: 1-[[3-[(3-ethyl-5-octyl-2-oxidanyl-phenyl)methyl]-5-octyl-2-oxidanyl-phenyl]methyl]-9-methyl-3,7-dioctyl-5H-benzo[d][1,3]benzodioxocin-11-one Openeye Name: 1-[[3-[(3-ethyl-2-hydroxy-5-octyl-phenyl)methyl]-2-hydroxy-5-octyl-phenyl]methyl]-9-methyl-3,7-dioctyl-5H-benzo[d][1,3]benzodioxocin-11-one CAS Name: 1-[[3-[(3-ethyl-2-hydroxy-5-octylphenyl)methyl]-2-hydroxy-5-octylphenyl]methyl]-9-methyl-3,7-dioctyl-5H-benzo[d][1,3]benzodioxocin-11-one IUPAC Name: 1-[[3-[(3-ethyl-2-hydroxy-5-octylphenyl)methyl]-2-hydroxy-5-octylphenyl]methyl]-9-methyl-3,7-dioctyl-5H-benzo[d][1,3]benzodioxocin-11-one Traditional Name: 1-[3-(3-ethyl-2-hydroxy-5-octyl-benzyl)-2-hydroxy-5-octyl-benzyl]-9-methyl-3,7-dioctyl-5H-benzo[d][1,3]benzodioxocin-11-one Formula: C63H92O5 MolecularWeight: 929.40158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C2C(=C1)CC3=CC(=CC(=C3OC(=O)O2)CC4=C(C(=CC(=C4)CCCCCCCC)CC5=C(C(=CC(=C5)CCCCCCCC)CC)O)O)CCCCCCCC)C

Isomeric SMILES

CCCCCCCCC1=CC(=C2C(=C1)CC3=CC(=CC(=C3OC(=O)O2)CC4=C(C(=CC(=C4)CCCCCCCC)CC5=C(C(=CC(=C5)CCCCCCCC)CC)O)O)CCCCCCCC)C

InChI

InChI=1S/C63H92O5/c1-7-12-16-20-24-28-32-48-36-47(6)61-56(41-48)46-58-43-51(35-31-27-23-19-15-10-4)42-57(62(58)68-63(66)67-61)45-55-40-50(34-30-26-22-18-14-9-3)39-54(60(55)65)44-53-38-49(37-52(11-5)59(53)64)33-29-25-21-17-13-8-2/h36-43,64-65H,7-35,44-46H2,1-6H3