[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride

Systemtic Name: [4-(2-piperidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride Openeye Name: [4-[2-(1-piperidyl)ethylcarbamoyl]phenyl]boronic acid hydrochloride CAS Name: [4-[oxo-[2-(1-piperidinyl)ethylamino]methyl]phenyl]boronic acid hydrochloride IUPAC Name: [4-(2-piperidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride Traditional Name: [4-(2-piperidinoethylcarbamoyl)phenyl]boronic acid hydrochloride Formula: C14H22BClN2O3 MolecularWeight: 312.60008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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