2-[1,3-benzodioxol-5-yl(morpholin-4-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[1,3-benzodioxol-5-yl(morpholin-4-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[1,3-benzodioxol-5-yl(morpholino)methyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[1,3-benzodioxol-5-yl(4-morpholinyl)methyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[1,3-benzodioxol-5-yl(morpholin-4-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[1,3-benzodioxol-5-yl(morpholino)methyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(C2=CC3=C(C=C2)OCO3)N4CCOCC4)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(C2=CC3=C(C=C2)OCO3)N4CCOCC4)C

InChI

InChI=1S/C20H25NO5/c1-20(2)10-14(22)18(15(23)11-20)19(21-5-7-24-8-6-21)13-3-4-16-17(9-13)26-12-25-16/h3-4,9,18-19H,5-8,10-12H2,1-2H3