2-[4-[2-(4-chlorophenyl)quinolin-4-yl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[2-(4-chlorophenyl)quinolin-4-yl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[2-(4-chlorophenyl)quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[2-(4-chlorophenyl)-4-quinolinyl]-oxomethyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[2-(4-chlorophenyl)quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[2-(4-chlorophenyl)quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C24H26ClN4O2+ MolecularWeight: 437.94184

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H25ClN4O2/c1-27(2)23(30)16-28-11-13-29(14-12-28)24(31)20-15-22(17-7-9-18(25)10-8-17)26-21-6-4-3-5-19(20)21/h3-10,15H,11-14,16H2,1-2H3/p+1