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

Systemtic Name: methyl 4-(2,5-dimethylphenyl)-2-methyl-butanoate Openeye Name: methyl 4-(2,5-dimethylphenyl)-2-methyl-butanoate CAS Name: 4-(2,5-dimethylphenyl)-2-methylbutanoic acid methyl ester IUPAC Name: methyl 4-(2,5-dimethylphenyl)-2-methylbutanoate Traditional Name: 4-(2,5-dimethylphenyl)-2-methyl-butyric acid methyl ester Formula: C14H20O2 MolecularWeight: 220.3074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O2/c1-10-5-6-11(2)13(9-10)8-7-12(3)14(15)16-4/h5-6,9,12H,7-8H2,1-4H3