methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoyl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoyl]oxymethyl]benzoate Openeye Name: methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-butanoyl]oxymethyl]benzoate CAS Name: 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,4-dioxobutoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoyl]oxymethyl]benzoate Traditional Name: 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-butanoyl]oxymethyl]benzoic acid methyl ester Formula: C21H20O7 MolecularWeight: 384.3793

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H20O7/c1-25-21(24)15-4-2-14(3-5-15)13-28-20(23)9-7-17(22)16-6-8-18-19(12-16)27-11-10-26-18/h2-6,8,12H,7,9-11,13H2,1H3