(3,3-dimethyl-2-oxidanylidene-butyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)benzoate CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)benzoate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C22H22O6 MolecularWeight: 382.40648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1C(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1C(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C22H22O6/c1-22(2,3)19(23)13-28-21(25)16-7-5-4-6-15(16)20(24)14-8-9-17-18(12-14)27-11-10-26-17/h4-9,12H,10-11,13H2,1-3H3