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

Systemtic Name: 2-[4-[2-(2-chlorophenyl)quinolin-4-yl]carbonylpiperazin-1-ium-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-[2-(2-chlorophenyl)quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-[[2-(2-chlorophenyl)-4-quinolinyl]-oxomethyl]-1-piperazin-1-iumyl]-N,N-diethylacetamide IUPAC Name: 2-[4-[2-(2-chlorophenyl)quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-[2-(2-chlorophenyl)quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N,N-diethyl-acetamide Formula: C26H30ClN4O2+ MolecularWeight: 465.995

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H29ClN4O2/c1-3-30(4-2)25(32)18-29-13-15-31(16-14-29)26(33)21-17-24(20-10-5-7-11-22(20)27)28-23-12-8-6-9-19(21)23/h5-12,17H,3-4,13-16,18H2,1-2H3/p+1