(2S)-2-(4-propan-2-ylphenyl)butanoate

Systemtic Name: (2S)-2-(4-propan-2-ylphenyl)butanoate Openeye Name: (2S)-2-(4-isopropylphenyl)butanoate CAS Name: (2S)-2-(4-propan-2-ylphenyl)butanoate IUPAC Name: (2S)-2-(4-propan-2-ylphenyl)butanoate Traditional Name: (2S)-2-p-cumenylbutyrate Formula: C13H17O2- MolecularWeight: 205.27288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2/c1-4-12(13(14)15)11-7-5-10(6-8-11)9(2)3/h5-9,12H,4H2,1-3H3,(H,14,15)/p-1/t12-/m0/s1