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

Systemtic Name: N-butyl-3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-methyl-benzamide Openeye Name: N-butyl-3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-methyl-benzamide CAS Name: N-butyl-3-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-methylbenzamide IUPAC Name: N-butyl-3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-methylbenzamide Traditional Name: N-butyl-N-methyl-3-(1-neopentylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C22H37N2O2+ MolecularWeight: 361.54138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=CC(=CC=C1)OC2CC[NH+](CC2)CC(C)(C)C

Isomeric SMILES

CCCCN(C)C(=O)C1=CC(=CC=C1)OC2CC[NH+](CC2)CC(C)(C)C

InChI

InChI=1S/C22H36N2O2/c1-6-7-13-23(5)21(25)18-9-8-10-20(16-18)26-19-11-14-24(15-12-19)17-22(2,3)4/h8-10,16,19H,6-7,11-15,17H2,1-5H3/p+1