(3R,5S)-3,5-dimethyl-N-(2-piperidin-1-ium-1-ylethyl)adamantane-1-carboxamide

Systemtic Name: (3R,5S)-3,5-dimethyl-N-(2-piperidin-1-ium-1-ylethyl)adamantane-1-carboxamide Openeye Name: (3R,5S)-3,5-dimethyl-N-(2-piperidin-1-ium-1-ylethyl)adamantane-1-carboxamide CAS Name: (3R,5S)-3,5-dimethyl-N-[2-(1-piperidin-1-iumyl)ethyl]-1-adamantanecarboxamide IUPAC Name: (3R,5S)-3,5-dimethyl-N-(2-piperidin-1-ium-1-ylethyl)adamantane-1-carboxamide Traditional Name: (3R,5S)-3,5-dimethyl-N-(2-piperidin-1-ium-1-ylethyl)adamantane-1-carboxamide Formula: C20H35N2O+ MolecularWeight: 319.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C(=O)NCC[NH+]4CCCCC4)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NCC[NH+]4CCCCC4)C

InChI

InChI=1S/C20H34N2O/c1-18-10-16-11-19(2,13-18)15-20(12-16,14-18)17(23)21-6-9-22-7-4-3-5-8-22/h16H,3-15H2,1-2H3,(H,21,23)/p+1/t16?,18-,19+,20?