2,2-dimethylpropyl 3-oxidanylidene-2-phenethyl-butanoate

Systemtic Name: 2,2-dimethylpropyl 3-oxidanylidene-2-phenethyl-butanoate Openeye Name: 2,2-dimethylpropyl 3-oxo-2-phenethyl-butanoate CAS Name: 3-oxo-2-phenethylbutanoic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 3-oxo-2-phenethylbutanoate Traditional Name: 3-keto-2-phenethyl-butyric acid neopentyl ester Formula: C17H24O3 MolecularWeight: 276.37066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1=CC=CC=C1)C(=O)OCC(C)(C)C

Isomeric SMILES

CC(=O)C(CCC1=CC=CC=C1)C(=O)OCC(C)(C)C

InChI

InChI=1S/C17H24O3/c1-13(18)15(16(19)20-12-17(2,3)4)11-10-14-8-6-5-7-9-14/h5-9,15H,10-12H2,1-4H3