6-tert-butylperoxy-2-heptyl-6-methyl-pyran-3-one

Systemtic Name: 6-tert-butylperoxy-2-heptyl-6-methyl-pyran-3-one Openeye Name: 6-tert-butylperoxy-2-heptyl-6-methyl-pyran-3-one CAS Name: 6-tert-butyldioxy-2-heptyl-6-methyl-3-pyranone IUPAC Name: 6-tert-butylperoxy-2-heptyl-6-methylpyran-3-one Traditional Name: 6-tert-butylperoxy-2-heptyl-6-methyl-pyran-3-one Formula: C17H30O4 MolecularWeight: 298.4177

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=O)C=CC(O1)(C)OOC(C)(C)C

Isomeric SMILES

CCCCCCCC1C(=O)C=CC(O1)(C)OOC(C)(C)C

InChI

InChI=1S/C17H30O4/c1-6-7-8-9-10-11-15-14(18)12-13-17(5,19-15)21-20-16(2,3)4/h12-13,15H,6-11H2,1-5H3