1-morpholin-4-yl-2-[4-[[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]methyl]piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-morpholin-4-yl-2-[4-[[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]methyl]piperazin-1-ium-1-yl]ethanone Openeye Name: 2-[4-[(3-benzyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholino-ethanone CAS Name: 1-(4-morpholinyl)-2-[4-[[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]methyl]-1-piperazin-1-iumyl]ethanone IUPAC Name: 2-[4-[(3-benzyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-[(3-benzyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholino-ethanone Formula: C21H31N5O2+2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCOCC2)CC3=[N+](C=CN3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCOCC2)CC3=[N+](C=CN3)CC4=CC=CC=C4

InChI

InChI=1S/C21H29N5O2/c27-21(25-12-14-28-15-13-25)18-24-10-8-23(9-11-24)17-20-22-6-7-26(20)16-19-4-2-1-3-5-19/h1-7H,8-18H2/p+2