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

Systemtic Name: 2-[1-[(4-ethoxyphenyl)methyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-[(4-ethoxyphenyl)methyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide CAS Name: 2-[1-[(4-ethoxyphenyl)methyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperidin-1-iumyl]acetamide IUPAC Name: 2-[1-[(4-ethoxyphenyl)methyl]-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(4-ethoxybenzyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Formula: C24H31N6O2+ MolecularWeight: 435.54194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[N+]2(CCCCC2CC(=O)N)C3=NC(=NC(=C3)C)N4C=CN=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C[N+]2(CCCCC2CC(=O)N)C3=NC(=NC(=C3)C)N4C=CN=C4

InChI

InChI=1S/C24H30N6O2/c1-3-32-21-9-7-19(8-10-21)16-30(13-5-4-6-20(30)15-22(25)31)23-14-18(2)27-24(28-23)29-12-11-26-17-29/h7-12,14,17,20H,3-6,13,15-16H2,1-2H3,(H-,25,31)/p+1