[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 5-(hydroxymethyl)-2-methyl-furan-3-carboxylate

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 5-(hydroxymethyl)-2-methyl-furan-3-carboxylate Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 5-(hydroxymethyl)-2-methyl-furan-3-carboxylate CAS Name: 5-(hydroxymethyl)-2-methyl-3-furancarboxylic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 5-(hydroxymethyl)-2-methylfuran-3-carboxylate Traditional Name: 2-methyl-5-methylol-furan-3-carboxylic acid [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C16H14O7 MolecularWeight: 318.27816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CO)C(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C=C(O1)CO)C(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H14O7/c1-9-12(5-11(6-17)23-9)16(19)20-7-13(18)10-2-3-14-15(4-10)22-8-21-14/h2-5,17H,6-8H2,1H3