(2R,3R)-2-cyano-3-(4-propan-2-ylphenyl)butanoate

Systemtic Name: (2R,3R)-2-cyano-3-(4-propan-2-ylphenyl)butanoate Openeye Name: (2R,3R)-2-cyano-3-(4-isopropylphenyl)butanoate CAS Name: (2R,3R)-2-cyano-3-(4-propan-2-ylphenyl)butanoate IUPAC Name: (2R,3R)-2-cyano-3-(4-propan-2-ylphenyl)butanoate Traditional Name: (2R,3R)-2-cyano-3-p-cumenyl-butyrate Formula: C14H16NO2- MolecularWeight: 230.28234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)C(C#N)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2/c1-9(2)11-4-6-12(7-5-11)10(3)13(8-15)14(16)17/h4-7,9-10,13H,1-3H3,(H,16,17)/p-1/t10-,13-/m0/s1