[6-[(2,3-dimethoxyphenyl)-(2-oxidanyl-4-oxidanylidene-furan-3-yl)methyl]-1,3-benzodioxol-5-yl] ethanoate

Systemtic Name: [6-[(2,3-dimethoxyphenyl)-(2-oxidanyl-4-oxidanylidene-furan-3-yl)methyl]-1,3-benzodioxol-5-yl] ethanoate Openeye Name: [6-[(2,3-dimethoxyphenyl)-(2-hydroxy-4-oxo-3-furyl)methyl]-1,3-benzodioxol-5-yl] acetate CAS Name: acetic acid [6-[(2,3-dimethoxyphenyl)-(2-hydroxy-4-oxo-3-furanyl)methyl]-1,3-benzodioxol-5-yl] ester IUPAC Name: [6-[(2,3-dimethoxyphenyl)-(2-hydroxy-4-oxofuran-3-yl)methyl]-1,3-benzodioxol-5-yl] acetate Traditional Name: acetic acid [6-[(2,3-dimethoxyphenyl)-(2-hydroxy-4-keto-3-furyl)methyl]-1,3-benzodioxol-5-yl] ester Formula: C22H20O9 MolecularWeight: 428.3888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1C(C3=C(C(=CC=C3)OC)OC)C4=C(OCC4=O)O)OCO2

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1C(C3=C(C(=CC=C3)OC)OC)C4=C(OCC4=O)O)OCO2

InChI

InChI=1S/C22H20O9/c1-11(23)31-16-8-18-17(29-10-30-18)7-13(16)19(20-14(24)9-28-22(20)25)12-5-4-6-15(26-2)21(12)27-3/h4-8,19,25H,9-10H2,1-3H3