1-morpholin-4-yl-2-[4-(2-phenylquinolin-4-yl)carbonylpiperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-morpholin-4-yl-2-[4-(2-phenylquinolin-4-yl)carbonylpiperazin-1-ium-1-yl]ethanone Openeye Name: 1-morpholino-2-[4-(2-phenylquinoline-4-carbonyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(4-morpholinyl)-2-[4-[oxo-(2-phenyl-4-quinolinyl)methyl]-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-morpholin-4-yl-2-[4-(2-phenylquinoline-4-carbonyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-morpholino-2-[4-(2-phenylquinoline-4-carbonyl)piperazin-1-ium-1-yl]ethanone Formula: C26H29N4O3+ MolecularWeight: 445.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCOCC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCOCC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H28N4O3/c31-25(29-14-16-33-17-15-29)19-28-10-12-30(13-11-28)26(32)22-18-24(20-6-2-1-3-7-20)27-23-9-5-4-8-21(22)23/h1-9,18H,10-17,19H2/p+1