ethyl 4-(3,5-dimethylphenyl)-2-ethyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(3,5-dimethylphenyl)-2-ethyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-(3,5-dimethylphenyl)-2-ethyl-3-oxo-butanoate CAS Name: 4-(3,5-dimethylphenyl)-2-ethyl-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(3,5-dimethylphenyl)-2-ethyl-3-oxobutanoate Traditional Name: 4-(3,5-dimethylphenyl)-2-ethyl-3-keto-butyric acid ethyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)CC1=CC(=CC(=C1)C)C)C(=O)OCC

Isomeric SMILES

CCC(C(=O)CC1=CC(=CC(=C1)C)C)C(=O)OCC

InChI

InChI=1S/C16H22O3/c1-5-14(16(18)19-6-2)15(17)10-13-8-11(3)7-12(4)9-13/h7-9,14H,5-6,10H2,1-4H3