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

Systemtic Name: [6-[(2-methoxyphenyl)-(2-oxidanyl-4-oxidanylidene-furan-3-yl)methyl]-1,3-benzodioxol-5-yl] ethanoate Openeye Name: [6-[(2-hydroxy-4-oxo-3-furyl)-(2-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] acetate CAS Name: acetic acid [6-[(2-hydroxy-4-oxo-3-furanyl)-(2-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] ester IUPAC Name: [6-[(2-hydroxy-4-oxofuran-3-yl)-(2-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] acetate Traditional Name: acetic acid [6-[(2-hydroxy-4-keto-3-furyl)-(2-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] ester Formula: C21H18O8 MolecularWeight: 398.36282

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1C(C3=CC=CC=C3OC)C4=C(OCC4=O)O)OCO2

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1C(C3=CC=CC=C3OC)C4=C(OCC4=O)O)OCO2

InChI

InChI=1S/C21H18O8/c1-11(22)29-16-8-18-17(27-10-28-18)7-13(16)19(20-14(23)9-26-21(20)24)12-5-3-4-6-15(12)25-2/h3-8,19,24H,9-10H2,1-2H3