N-[1-(phenylmethyl)piperidin-1-ium-4-yl]adamantane-1-carboxamide chloride

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]adamantane-1-carboxamide chloride Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)adamantane-1-carboxamide chloride CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1-adamantanecarboxamide chloride IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)adamantane-1-carboxamide chloride Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)adamantane-1-carboxamide chloride Formula: C23H33ClN2O MolecularWeight: 388.97392

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C23H32N2O.ClH/c26-22(23-13-18-10-19(14-23)12-20(11-18)15-23)24-21-6-8-25(9-7-21)16-17-4-2-1-3-5-17;/h1-5,18-21H,6-16H2,(H,24,26);1H