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

Systemtic Name: [3-chloranyl-4-(cyclohexylcarbamoyl)phenyl]boronic acid Openeye Name: [3-chloro-4-(cyclohexylcarbamoyl)phenyl]boronic acid CAS Name: [3-chloro-4-[(cyclohexylamino)-oxomethyl]phenyl]boronic acid IUPAC Name: [3-chloro-4-(cyclohexylcarbamoyl)phenyl]boronic acid Traditional Name: [3-chloro-4-(cyclohexylcarbamoyl)phenyl]boronic acid Formula: C13H17BClNO3 MolecularWeight: 281.54298

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)C(=O)NC2CCCCC2)Cl)(O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)C(=O)NC2CCCCC2)Cl)(O)O

InChI

InChI=1S/C13H17BClNO3/c15-12-8-9(14(18)19)6-7-11(12)13(17)16-10-4-2-1-3-5-10/h6-8,10,18-19H,1-5H2,(H,16,17)