methyl 5-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanoyl]oxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanoyl]oxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-butanoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,4-dioxobutoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-butanoyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C20H20O8 MolecularWeight: 388.368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H20O8/c1-24-20(23)17-7-4-14(28-17)12-27-19(22)8-5-15(21)13-3-6-16-18(11-13)26-10-2-9-25-16/h3-4,6-7,11H,2,5,8-10,12H2,1H3