methyl 2,2-dimethyl-3-oxidanyl-3-phenyl-butanoate

Systemtic Name: methyl 2,2-dimethyl-3-oxidanyl-3-phenyl-butanoate Openeye Name: methyl 3-hydroxy-2,2-dimethyl-3-phenyl-butanoate CAS Name: 3-hydroxy-2,2-dimethyl-3-phenylbutanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2,2-dimethyl-3-phenylbutanoate Traditional Name: 3-hydroxy-2,2-dimethyl-3-phenyl-butyric acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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