[4-(2-cyanoethylcarbamoyl)phenyl]boronic acid

Systemtic Name: [4-(2-cyanoethylcarbamoyl)phenyl]boronic acid Openeye Name: [4-(2-cyanoethylcarbamoyl)phenyl]boronic acid CAS Name: [4-[(2-cyanoethylamino)-oxomethyl]phenyl]boronic acid IUPAC Name: [4-(2-cyanoethylcarbamoyl)phenyl]boronic acid Traditional Name: [4-(2-cyanoethylcarbamoyl)phenyl]boronic acid Formula: C10H11BN2O3 MolecularWeight: 218.01694

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)NCCC#N)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)NCCC#N)(O)O

InChI

InChI=1S/C10H11BN2O3/c12-6-1-7-13-10(14)8-2-4-9(5-3-8)11(15)16/h2-5,15-16H,1,7H2,(H,13,14)