2-[(3-chlorophenyl)-(2,2-dimethylpropanoyl)amino]ethanoic acid

Systemtic Name: 2-[(3-chlorophenyl)-(2,2-dimethylpropanoyl)amino]ethanoic acid Openeye Name: 2-[3-chloro-N-(2,2-dimethylpropanoyl)anilino]acetic acid CAS Name: 2-(3-chloro-N-(2,2-dimethyl-1-oxopropyl)anilino)acetic acid IUPAC Name: 2-[3-chloro-N-(2,2-dimethylpropanoyl)anilino]acetic acid Traditional Name: 2-(3-chloro-N-pivaloyl-anilino)acetic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO3/c1-13(2,3)12(18)15(8-11(16)17)10-6-4-5-9(14)7-10/h4-7H,8H2,1-3H3,(H,16,17)