ethyl 4-(2,2-dimethylbutanoyl)benzoate

Systemtic Name: ethyl 4-(2,2-dimethylbutanoyl)benzoate Openeye Name: ethyl 4-(2,2-dimethylbutanoyl)benzoate CAS Name: 4-(2,2-dimethyl-1-oxobutyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2,2-dimethylbutanoyl)benzoate Traditional Name: 4-(2,2-dimethylbutanoyl)benzoic acid ethyl ester Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCC(C)(C)C(=O)C1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C15H20O3/c1-5-15(3,4)13(16)11-7-9-12(10-8-11)14(17)18-6-2/h7-10H,5-6H2,1-4H3