5-(3,4-dimethoxyphenyl)-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]oxan-2-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]oxan-2-one Openeye Name: 5-(3,4-dimethoxyphenyl)-3-[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydropyran-2-one CAS Name: 5-(3,4-dimethoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxanone IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxan-2-one Traditional Name: 5-(3,4-dimethoxyphenyl)-3-vanillyl-tetrahydropyran-2-one Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(C(=O)OC2)CC3=CC(=C(C=C3)O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(C(=O)OC2)CC3=CC(=C(C=C3)O)OC)OC

InChI

InChI=1S/C21H24O6/c1-24-18-7-5-14(11-20(18)26-3)16-10-15(21(23)27-12-16)8-13-4-6-17(22)19(9-13)25-2/h4-7,9,11,15-16,22H,8,10,12H2,1-3H3