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

Systemtic Name: 2-[1-(1-cyclohex-2-en-1-ylethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-(1-cyclohex-2-en-1-ylethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide CAS Name: 2-[1-[1-(1-cyclohex-2-enyl)ethyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperidin-1-iumyl]acetamide IUPAC Name: 2-[1-(1-cyclohex-2-en-1-ylethyl)-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(1-cyclohex-2-en-1-ylethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Formula: C23H33N6O+ MolecularWeight: 409.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)[N+]3(CCCCC3CC(=O)N)C(C)C4CCCC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)[N+]3(CCCCC3CC(=O)N)C(C)C4CCCC=C4

InChI

InChI=1S/C23H32N6O/c1-17-14-22(27-23(26-17)28-12-11-25-16-28)29(18(2)19-8-4-3-5-9-19)13-7-6-10-20(29)15-21(24)30/h4,8,11-12,14,16,18-20H,3,5-7,9-10,13,15H2,1-2H3,(H-,24,30)/p+1