5-[(3,5-dioctyl-4-oxidanyl-phenyl)methyl]nonane-4,6-dione

Systemtic Name: 5-[(3,5-dioctyl-4-oxidanyl-phenyl)methyl]nonane-4,6-dione Openeye Name: 5-[(4-hydroxy-3,5-dioctyl-phenyl)methyl]nonane-4,6-dione CAS Name: 5-[(4-hydroxy-3,5-dioctylphenyl)methyl]nonane-4,6-dione IUPAC Name: 5-[(4-hydroxy-3,5-dioctylphenyl)methyl]nonane-4,6-dione Traditional Name: 5-(4-hydroxy-3,5-dioctyl-benzyl)nonane-4,6-dione Formula: C32H54O3 MolecularWeight: 486.76936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=CC(=C1O)CCCCCCCC)CC(C(=O)CCC)C(=O)CCC

Isomeric SMILES

CCCCCCCCC1=CC(=CC(=C1O)CCCCCCCC)CC(C(=O)CCC)C(=O)CCC

InChI

InChI=1S/C32H54O3/c1-5-9-11-13-15-17-21-27-23-26(25-29(30(33)19-7-3)31(34)20-8-4)24-28(32(27)35)22-18-16-14-12-10-6-2/h23-24,29,35H,5-22,25H2,1-4H3