methyl 2,2-dimethyl-4-(3-methylphenyl)-3-oxidanylidene-butanoate

Systemtic Name: methyl 2,2-dimethyl-4-(3-methylphenyl)-3-oxidanylidene-butanoate Openeye Name: methyl 2,2-dimethyl-4-(m-tolyl)-3-oxo-butanoate CAS Name: 2,2-dimethyl-4-(3-methylphenyl)-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-4-(3-methylphenyl)-3-oxobutanoate Traditional Name: 3-keto-2,2-dimethyl-4-(m-tolyl)butyric acid methyl ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)C(C)(C)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)C(C)(C)C(=O)OC

InChI

InChI=1S/C14H18O3/c1-10-6-5-7-11(8-10)9-12(15)14(2,3)13(16)17-4/h5-8H,9H2,1-4H3