(5-bromanylpyridin-3-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone hydrochloride

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone hydrochloride Openeye Name: (4-benzylpiperazin-1-yl)-(5-bromo-3-pyridyl)methanone hydrochloride CAS Name: (5-bromo-3-pyridinyl)-[4-(phenylmethyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: (4-benzylpiperazin-1-yl)-(5-bromopyridin-3-yl)methanone hydrochloride Traditional Name: (4-benzylpiperazino)-(5-bromo-3-pyridyl)methanone hydrochloride Formula: C17H19BrClN3O MolecularWeight: 396.70926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CN=C3)Br.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CN=C3)Br.Cl

InChI

InChI=1S/C17H18BrN3O.ClH/c18-16-10-15(11-19-12-16)17(22)21-8-6-20(7-9-21)13-14-4-2-1-3-5-14;/h1-5,10-12H,6-9,13H2;1H