1-pyrrolidin-1-yl-2-(4-quinolin-2-ylcarbonylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-pyrrolidin-1-yl-2-(4-quinolin-2-ylcarbonylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-pyrrolidin-1-yl-2-[4-(quinoline-2-carbonyl)piperazin-1-ium-1-yl]ethanone CAS Name: 2-[4-[oxo(2-quinolinyl)methyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 1-pyrrolidin-1-yl-2-[4-(quinoline-2-carbonyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-pyrrolidino-2-(4-quinaldoylpiperazin-1-ium-1-yl)ethanone Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H24N4O2/c25-19(23-9-3-4-10-23)15-22-11-13-24(14-12-22)20(26)18-8-7-16-5-1-2-6-17(16)21-18/h1-2,5-8H,3-4,9-15H2/p+1