2-[4-[2-(3-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[2-(3-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[2-(3-chlorophenyl)-3-methyl-quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[[2-(3-chlorophenyl)-3-methyl-4-quinolinyl]-oxomethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[2-(3-chlorophenyl)-3-methylquinoline-4-carbonyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[2-(3-chlorophenyl)-3-methyl-quinoline-4-carbonyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C26H30ClN4O2+ MolecularWeight: 465.995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)N4CC[NH+](CC4)CC(=O)NC(C)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)N4CC[NH+](CC4)CC(=O)NC(C)C

InChI

InChI=1S/C26H29ClN4O2/c1-17(2)28-23(32)16-30-11-13-31(14-12-30)26(33)24-18(3)25(19-7-6-8-20(27)15-19)29-22-10-5-4-9-21(22)24/h4-10,15,17H,11-14,16H2,1-3H3,(H,28,32)/p+1