methyl 2-(3,4-dimethylphenyl)butanoate

Systemtic Name: methyl 2-(3,4-dimethylphenyl)butanoate Openeye Name: methyl 2-(3,4-dimethylphenyl)butanoate CAS Name: 2-(3,4-dimethylphenyl)butanoic acid methyl ester IUPAC Name: methyl 2-(3,4-dimethylphenyl)butanoate Traditional Name: 2-(3,4-dimethylphenyl)butyric acid methyl ester Formula: C13H18O2 MolecularWeight: 206.28082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2/c1-5-12(13(14)15-4)11-7-6-9(2)10(3)8-11/h6-8,12H,5H2,1-4H3