N-[4-(2-piperidin-1-ium-1-ylethanoylamino)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(2-piperidin-1-ium-1-ylethanoylamino)phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[(2-piperidin-1-ium-1-ylacetyl)amino]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[[1-oxo-2-(1-piperidin-1-iumyl)ethyl]amino]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[(2-piperidin-1-ium-1-ylacetyl)amino]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[(2-piperidin-1-ium-1-ylacetyl)amino]phenyl]adamantane-1-carboxamide Formula: C24H34N3O2+ MolecularWeight: 396.54566

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H33N3O2/c28-22(16-27-8-2-1-3-9-27)25-20-4-6-21(7-5-20)26-23(29)24-13-17-10-18(14-24)12-19(11-17)15-24/h4-7,17-19H,1-3,8-16H2,(H,25,28)(H,26,29)/p+1