4-chloranyl-3-(2,2-dimethylpropanoylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(2,2-dimethylpropanoylamino)benzoic acid Openeye Name: 4-chloro-3-(2,2-dimethylpropanoylamino)benzoic acid CAS Name: 4-chloro-3-[(2,2-dimethyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 4-chloro-3-(2,2-dimethylpropanoylamino)benzoic acid Traditional Name: 4-chloro-3-(pivaloylamino)benzoic acid Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl

InChI

InChI=1S/C12H14ClNO3/c1-12(2,3)11(17)14-9-6-7(10(15)16)4-5-8(9)13/h4-6H,1-3H3,(H,14,17)(H,15,16)