(2R,3R)-3-(4-tert-butylphenyl)-2-cyano-butanoic acid

Systemtic Name: (2R,3R)-3-(4-tert-butylphenyl)-2-cyano-butanoic acid Openeye Name: (2R,3R)-3-(4-tert-butylphenyl)-2-cyano-butanoic acid CAS Name: (2R,3R)-3-(4-tert-butylphenyl)-2-cyanobutanoic acid IUPAC Name: (2R,3R)-3-(4-tert-butylphenyl)-2-cyanobutanoic acid Traditional Name: (2R,3R)-3-(4-tert-butylphenyl)-2-cyano-butyric acid Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO2/c1-10(13(9-16)14(17)18)11-5-7-12(8-6-11)15(2,3)4/h5-8,10,13H,1-4H3,(H,17,18)/t10-,13-/m0/s1