N-(1-adamantylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetamide Formula: C23H34N3O2+ MolecularWeight: 384.53496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H33N3O2/c1-3-19(4-2)20-5-7-26(8-6-20)15-21(27)24-22(28)25-23-12-16-9-17(13-23)11-18(10-16)14-23/h5-8,16-19H,3-4,9-15H2,1-2H3,(H-,24,25,27,28)/p+1