methyl 4-(2,5-dimethylphenyl)-2-methyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(2,5-dimethylphenyl)-2-methyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-(2,5-dimethylphenyl)-2-methyl-4-oxo-butanoate CAS Name: 4-(2,5-dimethylphenyl)-2-methyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(2,5-dimethylphenyl)-2-methyl-4-oxobutanoate Traditional Name: 4-(2,5-dimethylphenyl)-4-keto-2-methyl-butyric acid methyl ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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