(5-bromanylpyridin-3-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (5-bromo-3-pyridyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (5-bromo-3-pyridinyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (5-bromopyridin-3-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (5-bromo-3-pyridyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C15H16BrN4O+ MolecularWeight: 348.21774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C15H15BrN4O/c16-13-9-12(10-17-11-13)15(21)20-7-5-19(6-8-20)14-3-1-2-4-18-14/h1-4,9-11H,5-8H2/p+1