[4-chloranyl-3-(propylcarbamoyl)phenyl]boronic acid

Systemtic Name: [4-chloranyl-3-(propylcarbamoyl)phenyl]boronic acid Openeye Name: [4-chloro-3-(propylcarbamoyl)phenyl]boronic acid CAS Name: [4-chloro-3-[oxo(propylamino)methyl]phenyl]boronic acid IUPAC Name: [4-chloro-3-(propylcarbamoyl)phenyl]boronic acid Traditional Name: [4-chloro-3-(propylcarbamoyl)phenyl]boronic acid Formula: C10H13BClNO3 MolecularWeight: 241.47912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13BClNO3/c1-2-5-13-10(14)8-6-7(11(15)16)3-4-9(8)12/h3-4,6,15-16H,2,5H2,1H3,(H,13,14)