[4-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride

Systemtic Name: [4-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride Openeye Name: [4-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride CAS Name: [4-[(2-diethylaminoethylamino)-oxomethyl]phenyl]boronic acid hydrochloride IUPAC Name: [4-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride Traditional Name: [4-(2-diethylaminoethylcarbamoyl)phenyl]boronic acid hydrochloride Formula: C13H22BClN2O3 MolecularWeight: 300.58938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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