2-[[2,4-dibutyl-6-(3,5-dibutylphenyl)phenoxy]methyl]oxirane

Systemtic Name: 2-[[2,4-dibutyl-6-(3,5-dibutylphenyl)phenoxy]methyl]oxirane Openeye Name: 2-[[2,4-dibutyl-6-(3,5-dibutylphenyl)phenoxy]methyl]oxirane CAS Name: 2-[[2,4-dibutyl-6-(3,5-dibutylphenyl)phenoxy]methyl]oxirane IUPAC Name: 2-[[2,4-dibutyl-6-(3,5-dibutylphenyl)phenoxy]methyl]oxirane Traditional Name: 2-[[2,4-dibutyl-6-(3,5-dibutylphenyl)phenoxy]methyl]oxirane Formula: C31H46O2 MolecularWeight: 450.69574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1)C2=CC(=CC(=C2OCC3CO3)CCCC)CCCC)CCCC

Isomeric SMILES

CCCCC1=CC(=CC(=C1)C2=CC(=CC(=C2OCC3CO3)CCCC)CCCC)CCCC

InChI

InChI=1S/C31H46O2/c1-5-9-13-24-17-25(14-10-6-2)20-28(19-24)30-21-26(15-11-7-3)18-27(16-12-8-4)31(30)33-23-29-22-32-29/h17-21,29H,5-16,22-23H2,1-4H3