N-[[(3R)-1-(2,2-dimethylpropyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[[(3R)-1-(2,2-dimethylpropyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide Openeye Name: N-[[(3R)-1-(2,2-dimethylpropyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide CAS Name: N-[[(3R)-1-(2,2-dimethylpropyl)-3-piperidin-1-iumyl]methyl]-3,5-dimethoxybenzamide IUPAC Name: N-[[(3R)-1-(2,2-dimethylpropyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxybenzamide Traditional Name: 3,5-dimethoxy-N-[[(3R)-1-neopentylpiperidin-1-ium-3-yl]methyl]benzamide Formula: C20H33N2O3+ MolecularWeight: 349.48762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCCC(C1)CNC(=O)C2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC(C)(C)C[NH+]1CCC[C@@H](C1)CNC(=O)C2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C20H32N2O3/c1-20(2,3)14-22-8-6-7-15(13-22)12-21-19(23)16-9-17(24-4)11-18(10-16)25-5/h9-11,15H,6-8,12-14H2,1-5H3,(H,21,23)/p+1/t15-/m1/s1