(2R)-3-(4-tert-butylphenyl)-2-cyano-propanoic acid

Systemtic Name: (2R)-3-(4-tert-butylphenyl)-2-cyano-propanoic acid Openeye Name: (2R)-3-(4-tert-butylphenyl)-2-cyano-propanoic acid CAS Name: (2R)-3-(4-tert-butylphenyl)-2-cyanopropanoic acid IUPAC Name: (2R)-3-(4-tert-butylphenyl)-2-cyanopropanoic acid Traditional Name: (2R)-3-(4-tert-butylphenyl)-2-cyano-propionic acid Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC(C#N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2/c1-14(2,3)12-6-4-10(5-7-12)8-11(9-15)13(16)17/h4-7,11H,8H2,1-3H3,(H,16,17)/t11-/m1/s1