[5-chloranyl-2-(2,2-dimethylpropanoylamino)phenyl]boronic acid

Systemtic Name: [5-chloranyl-2-(2,2-dimethylpropanoylamino)phenyl]boronic acid Openeye Name: [5-chloro-2-(2,2-dimethylpropanoylamino)phenyl]boronic acid CAS Name: [5-chloro-2-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]boronic acid IUPAC Name: [5-chloro-2-(2,2-dimethylpropanoylamino)phenyl]boronic acid Traditional Name: [5-chloro-2-(pivaloylamino)phenyl]boronic acid Formula: C11H15BClNO3 MolecularWeight: 255.5057

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C=CC(=C1)Cl)NC(=O)C(C)(C)C)(O)O

Isomeric SMILES

B(C1=C(C=CC(=C1)Cl)NC(=O)C(C)(C)C)(O)O

InChI

InChI=1S/C11H15BClNO3/c1-11(2,3)10(15)14-9-5-4-7(13)6-8(9)12(16)17/h4-6,16-17H,1-3H3,(H,14,15)