[3-(2-piperidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride

Systemtic Name: [3-(2-piperidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride Openeye Name: [3-[2-(1-piperidyl)ethylcarbamoyl]phenyl]boronic acid hydrochloride CAS Name: [3-[oxo-[2-(1-piperidinyl)ethylamino]methyl]phenyl]boronic acid hydrochloride IUPAC Name: [3-(2-piperidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride Traditional Name: [3-(2-piperidinoethylcarbamoyl)phenyl]boronic acid hydrochloride Formula: C14H22BClN2O3 MolecularWeight: 312.60008

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC=C1)C(=O)NCCN2CCCCC2)(O)O.Cl

Isomeric SMILES

B(C1=CC(=CC=C1)C(=O)NCCN2CCCCC2)(O)O.Cl

InChI

InChI=1S/C14H21BN2O3.ClH/c18-14(12-5-4-6-13(11-12)15(19)20)16-7-10-17-8-2-1-3-9-17;/h4-6,11,19-20H,1-3,7-10H2,(H,16,18);1H