2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(6-methylheptan-2-yl)piperidin-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(6-methylheptan-2-yl)piperidin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-(1,5-dimethylhexyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide CAS Name: 2-[1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-1-(6-methylheptan-2-yl)-2-piperidin-1-iumyl]acetamide IUPAC Name: 2-[1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-1-(6-methylheptan-2-yl)piperidin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(1,5-dimethylhexyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Formula: C23H37N6O+ MolecularWeight: 413.57948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)[N+]3(CCCCC3CC(=O)N)C(C)CCCC(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)[N+]3(CCCCC3CC(=O)N)C(C)CCCC(C)C

InChI

InChI=1S/C23H36N6O/c1-17(2)8-7-9-19(4)29(13-6-5-10-20(29)15-21(24)30)22-14-18(3)26-23(27-22)28-12-11-25-16-28/h11-12,14,16-17,19-20H,5-10,13,15H2,1-4H3,(H-,24,30)/p+1