methyl 2,2-dimethyl-3-(4-methylphenyl)-3-oxidanyl-propanoate

Systemtic Name: methyl 2,2-dimethyl-3-(4-methylphenyl)-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2,2-dimethyl-3-(p-tolyl)propanoate CAS Name: 3-hydroxy-2,2-dimethyl-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2,2-dimethyl-3-(4-methylphenyl)propanoate Traditional Name: 3-hydroxy-2,2-dimethyl-3-(p-tolyl)propionic acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-9-5-7-10(8-6-9)11(14)13(2,3)12(15)16-4/h5-8,11,14H,1-4H3