(2S)-3-methyl-2-(3-methylphenyl)butanoate

Systemtic Name: (2S)-3-methyl-2-(3-methylphenyl)butanoate Openeye Name: (2S)-3-methyl-2-(m-tolyl)butanoate CAS Name: (2S)-3-methyl-2-(3-methylphenyl)butanoate IUPAC Name: (2S)-3-methyl-2-(3-methylphenyl)butanoate Traditional Name: (2S)-3-methyl-2-(m-tolyl)butyrate Formula: C12H15O2- MolecularWeight: 191.2463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)[C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C12H16O2/c1-8(2)11(12(13)14)10-6-4-5-9(3)7-10/h4-8,11H,1-3H3,(H,13,14)/p-1/t11-/m0/s1