(2S)-2-cyclobutyl-2-(2,5-dimethylphenyl)ethanoate

Systemtic Name: (2S)-2-cyclobutyl-2-(2,5-dimethylphenyl)ethanoate Openeye Name: (2S)-2-cyclobutyl-2-(2,5-dimethylphenyl)acetate CAS Name: (2S)-2-cyclobutyl-2-(2,5-dimethylphenyl)acetate IUPAC Name: (2S)-2-cyclobutyl-2-(2,5-dimethylphenyl)acetate Traditional Name: (2S)-2-cyclobutyl-2-(2,5-dimethylphenyl)acetate Formula: C14H17O2- MolecularWeight: 217.28358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2CCC2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@H](C2CCC2)C(=O)[O-]

InChI

InChI=1S/C14H18O2/c1-9-6-7-10(2)12(8-9)13(14(15)16)11-4-3-5-11/h6-8,11,13H,3-5H2,1-2H3,(H,15,16)/p-1/t13-/m0/s1