2-[(3,4-dimethoxyphenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[(3,4-dimethoxyphenyl)-(2-hydroxy-6-oxo-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one CAS Name: 2-[(3,4-dimethoxyphenyl)-(2-hydroxy-6-oxo-1-cyclohexenyl)methyl]-3-hydroxy-1-cyclohex-2-enone IUPAC Name: 2-[(3,4-dimethoxyphenyl)-(2-hydroxy-6-oxocyclohexen-1-yl)methyl]-3-hydroxycyclohex-2-en-1-one Traditional Name: 2-[(3,4-dimethoxyphenyl)-(2-hydroxy-6-keto-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=C(CCCC2=O)O)C3=C(CCCC3=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=C(CCCC2=O)O)C3=C(CCCC3=O)O)OC

InChI

InChI=1S/C21H24O6/c1-26-17-10-9-12(11-18(17)27-2)19(20-13(22)5-3-6-14(20)23)21-15(24)7-4-8-16(21)25/h9-11,19,22,24H,3-8H2,1-2H3