(5-bromanylfuran-2-yl)-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-bromanylfuran-2-yl)-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (5-bromo-2-furyl)-[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]methanone CAS Name: (5-bromo-2-furanyl)-[4-[2-(2-pyridinyl)ethyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-bromofuran-2-yl)-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (5-bromo-2-furyl)-[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]methanone Formula: C16H19BrN3O2+ MolecularWeight: 365.24496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=N2)C(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=N2)C(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C16H18BrN3O2/c17-15-5-4-14(22-15)16(21)20-11-9-19(10-12-20)8-6-13-3-1-2-7-18-13/h1-5,7H,6,8-12H2/p+1