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

Systemtic Name: methyl 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoyl]oxymethyl]benzoate Openeye Name: methyl 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-butanoyl]oxymethyl]benzoate CAS Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,4-dioxobutoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoyl]oxymethyl]benzoate Traditional Name: 3-[[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(=CC=C1)COC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

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

InChI

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