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

Systemtic Name: [3-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride Openeye Name: [3-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride CAS Name: [3-[oxo-[2-(1-pyrrolidinyl)ethylamino]methyl]phenyl]boronic acid hydrochloride IUPAC Name: [3-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]boronic acid hydrochloride Traditional Name: [3-(2-pyrrolidinoethylcarbamoyl)phenyl]boronic acid hydrochloride Formula: C13H20BClN2O3 MolecularWeight: 298.5735

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC=C1)C(=O)NCCN2CCCC2)(O)O.Cl

Isomeric SMILES

B(C1=CC(=CC=C1)C(=O)NCCN2CCCC2)(O)O.Cl

InChI

InChI=1S/C13H19BN2O3.ClH/c17-13(15-6-9-16-7-1-2-8-16)11-4-3-5-12(10-11)14(18)19;/h3-5,10,18-19H,1-2,6-9H2,(H,15,17);1H