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

Systemtic Name: 4-[6-(1,3-benzodioxol-5-yl)hexyl]heptane-3,5-dione Openeye Name: 4-[6-(1,3-benzodioxol-5-yl)hexyl]heptane-3,5-dione CAS Name: 4-[6-(1,3-benzodioxol-5-yl)hexyl]heptane-3,5-dione IUPAC Name: 4-[6-(1,3-benzodioxol-5-yl)hexyl]heptane-3,5-dione Traditional Name: 4-[6-(1,3-benzodioxol-5-yl)hexyl]heptane-3,5-dione Formula: C20H28O4 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCC1=CC2=C(C=C1)OCO2)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCC1=CC2=C(C=C1)OCO2)C(=O)CC

InChI

InChI=1S/C20H28O4/c1-3-17(21)16(18(22)4-2)10-8-6-5-7-9-15-11-12-19-20(13-15)24-14-23-19/h11-13,16H,3-10,14H2,1-2H3