[3-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride

Systemtic Name: [3-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride Openeye Name: [3-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride CAS Name: [3-[(2-diethylaminoethylamino)-oxomethyl]phenyl]boronic acid hydrochloride IUPAC Name: [3-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride Traditional Name: [3-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride Formula: C13H22BClN2O3 MolecularWeight: 300.58938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21BN2O3.ClH/c1-3-16(4-2)9-8-15-13(17)11-6-5-7-12(10-11)14(18)19;/h5-7,10,18-19H,3-4,8-9H2,1-2H3,(H,15,17);1H