3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(1-methylimidazol-2-yl)methyl]benzamide

Systemtic Name: 3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(1-methylimidazol-2-yl)methyl]benzamide Openeye Name: 3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(1-methylimidazol-2-yl)methyl]benzamide CAS Name: 3-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-[(1-methyl-2-imidazolyl)methyl]benzamide IUPAC Name: 3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(1-methylimidazol-2-yl)methyl]benzamide Traditional Name: N-[(1-methylimidazol-2-yl)methyl]-3-(1-neopentylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCC(CC1)OC2=CC=CC(=C2)C(=O)NCC3=NC=CN3C

Isomeric SMILES

CC(C)(C)C[NH+]1CCC(CC1)OC2=CC=CC(=C2)C(=O)NCC3=NC=CN3C

InChI

InChI=1S/C22H32N4O2/c1-22(2,3)16-26-11-8-18(9-12-26)28-19-7-5-6-17(14-19)21(27)24-15-20-23-10-13-25(20)4/h5-7,10,13-14,18H,8-9,11-12,15-16H2,1-4H3,(H,24,27)/p+1