N-phenyl-2-[4-(4-phenylquinolin-2-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-phenyl-2-[4-(4-phenylquinolin-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-phenyl-2-[4-(4-phenyl-2-quinolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-phenyl-2-[4-(4-phenyl-2-quinolinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-phenyl-2-[4-(4-phenylquinolin-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-phenyl-2-[4-(4-phenyl-2-quinolyl)piperazin-1-ium-1-yl]acetamide Formula: C27H27N4O+ MolecularWeight: 423.52948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O/c32-27(28-22-11-5-2-6-12-22)20-30-15-17-31(18-16-30)26-19-24(21-9-3-1-4-10-21)23-13-7-8-14-25(23)29-26/h1-14,19H,15-18,20H2,(H,28,32)/p+1