5-bromanyl-N-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furan-2-carboxamide CAS Name: 5-bromo-N-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]-2-furamide Formula: C16H18BrN4O3+ MolecularWeight: 394.24312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CNC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CNC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C16H17BrN4O3/c17-13-5-4-12(24-13)16(23)19-11-15(22)21-9-7-20(8-10-21)14-3-1-2-6-18-14/h1-6H,7-11H2,(H,19,23)/p+1