3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(2-methylprop-2-enyl)benzamide

Systemtic Name: 3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(2-methylprop-2-enyl)benzamide Openeye Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(2-methylallyl)benzamide CAS Name: 3-chloro-4-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-(2-methylprop-2-enyl)benzamide IUPAC Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(2-methylprop-2-enyl)benzamide Traditional Name: 3-chloro-N-(2-methylallyl)-4-(1-neopentylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C21H32ClN2O2+ MolecularWeight: 379.94398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31ClN2O2/c1-15(2)13-23-20(25)16-6-7-19(18(22)12-16)26-17-8-10-24(11-9-17)14-21(3,4)5/h6-7,12,17H,1,8-11,13-14H2,2-5H3,(H,23,25)/p+1