4-[6-(1,3-benzodioxol-5-yloxy)hexyl]heptane-3,5-dione

Systemtic Name: 4-[6-(1,3-benzodioxol-5-yloxy)hexyl]heptane-3,5-dione Openeye Name: 4-[6-(1,3-benzodioxol-5-yloxy)hexyl]heptane-3,5-dione CAS Name: 4-[6-(1,3-benzodioxol-5-yloxy)hexyl]heptane-3,5-dione IUPAC Name: 4-[6-(1,3-benzodioxol-5-yloxy)hexyl]heptane-3,5-dione Traditional Name: 4-[6-(1,3-benzodioxol-5-yloxy)hexyl]heptane-3,5-dione Formula: C20H28O5 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCOC1=CC2=C(C=C1)OCO2)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCOC1=CC2=C(C=C1)OCO2)C(=O)CC

InChI

InChI=1S/C20H28O5/c1-3-17(21)16(18(22)4-2)9-7-5-6-8-12-23-15-10-11-19-20(13-15)25-14-24-19/h10-11,13,16H,3-9,12,14H2,1-2H3