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

Systemtic Name: N-(furan-2-ylmethylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(2-furylmethylcarbamoyl)acetamide CAS Name: N-[(2-furanylmethylamino)-oxomethyl]-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(furan-2-ylmethylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(2-furfurylcarbamoyl)acetamide Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(=O)NCC2=CC=CO2

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C18H23N3O3/c1-3-14(4-2)15-7-9-21(10-8-15)13-17(22)20-18(23)19-12-16-6-5-11-24-16/h5-11,14H,3-4,12-13H2,1-2H3,(H-,19,20,22,23)/p+1