2-[1,3-benzodioxol-5-yl-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1,3-benzodioxol-5-yl-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[1,3-benzodioxol-5-yl-(2-hydroxy-6-oxo-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one CAS Name: 2-[1,3-benzodioxol-5-yl-(2-hydroxy-6-oxo-1-cyclohexenyl)methyl]-3-hydroxy-1-cyclohex-2-enone IUPAC Name: 2-[1,3-benzodioxol-5-yl-(2-hydroxy-6-oxocyclohexen-1-yl)methyl]-3-hydroxycyclohex-2-en-1-one Traditional Name: 2-[1,3-benzodioxol-5-yl-(2-hydroxy-6-keto-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one Formula: C20H20O6 MolecularWeight: 356.3692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)C1)C(C2=CC3=C(C=C2)OCO3)C4=C(CCCC4=O)O)O

Isomeric SMILES

C1CC(=C(C(=O)C1)C(C2=CC3=C(C=C2)OCO3)C4=C(CCCC4=O)O)O

InChI

InChI=1S/C20H20O6/c21-12-3-1-4-13(22)19(12)18(20-14(23)5-2-6-15(20)24)11-7-8-16-17(9-11)26-10-25-16/h7-9,18,21,23H,1-6,10H2