2-[(4-cyanophenyl)carbonyl-methyl-amino]-2-methyl-propanoic acid

Systemtic Name: 2-[(4-cyanophenyl)carbonyl-methyl-amino]-2-methyl-propanoic acid Openeye Name: 2-[(4-cyanobenzoyl)-methyl-amino]-2-methyl-propanoic acid CAS Name: 2-[[(4-cyanophenyl)-oxomethyl]-methylamino]-2-methylpropanoic acid IUPAC Name: 2-[(4-cyanobenzoyl)-methylamino]-2-methylpropanoic acid Traditional Name: 2-[(4-cyanobenzoyl)-methyl-amino]-2-methyl-propionic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3/c1-13(2,12(17)18)15(3)11(16)10-6-4-9(8-14)5-7-10/h4-7H,1-3H3,(H,17,18)