[3-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethoxy]phenyl]methyl-(1H-imidazol-2-ylmethyl)-methyl-azanium

Systemtic Name: [3-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethoxy]phenyl]methyl-(1H-imidazol-2-ylmethyl)-methyl-azanium Openeye Name: [3-[2-(4-acetylpiperazin-1-ium-1-yl)ethoxy]phenyl]methyl-(1H-imidazol-2-ylmethyl)-methyl-ammonium CAS Name: [3-[2-(4-acetyl-1-piperazin-1-iumyl)ethoxy]phenyl]methyl-(1H-imidazol-2-ylmethyl)-methylammonium IUPAC Name: [3-[2-(4-acetylpiperazin-1-ium-1-yl)ethoxy]phenyl]methyl-(1H-imidazol-2-ylmethyl)-methylazanium Traditional Name: [3-[2-(4-acetylpiperazin-1-ium-1-yl)ethoxy]benzyl]-(1H-imidazol-2-ylmethyl)-methyl-ammonium Formula: C20H31N5O2+2 MolecularWeight: 373.49244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CCOC2=CC=CC(=C2)C[NH+](C)CC3=NC=CN3

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CCOC2=CC=CC(=C2)C[NH+](C)CC3=NC=CN3

InChI

InChI=1S/C20H29N5O2/c1-17(26)25-10-8-24(9-11-25)12-13-27-19-5-3-4-18(14-19)15-23(2)16-20-21-6-7-22-20/h3-7,14H,8-13,15-16H2,1-2H3,(H,21,22)/p+2