3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-butanoic acid

Systemtic Name: 3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-butanoic acid Openeye Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-butanoic acid CAS Name: 3-[[(4-cyanophenyl)-oxomethyl]amino]-2,2-dimethylbutanoic acid IUPAC Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethylbutanoic acid Traditional Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-butyric acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3/c1-9(14(2,3)13(18)19)16-12(17)11-6-4-10(8-15)5-7-11/h4-7,9H,1-3H3,(H,16,17)(H,18,19)