2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(5-bromo-2-furanyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(5-bromo-2-furoyl)piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C15H21BrN3O3+ MolecularWeight: 371.24954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C15H20BrN3O3/c16-13-4-3-12(22-13)15(21)19-9-7-17(8-10-19)11-14(20)18-5-1-2-6-18/h3-4H,1-2,5-11H2/p+1