N-(4-fluorophenyl)-2-[2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanoylamino]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: 2-[[2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetyl]amino]-N-(4-fluorophenyl)acetamide CAS Name: N-(4-fluorophenyl)-2-[[1-oxo-2-(4-pentan-3-yl-1-pyridin-1-iumyl)ethyl]amino]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[[2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetyl]amino]acetamide Traditional Name: 2-[[2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetyl]amino]-N-(4-fluorophenyl)acetamide Formula: C20H25FN3O2+ MolecularWeight: 358.429803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C20H24FN3O2/c1-3-15(4-2)16-9-11-24(12-10-16)14-20(26)22-13-19(25)23-18-7-5-17(21)6-8-18/h5-12,15H,3-4,13-14H2,1-2H3,(H-,22,23,25,26)/p+1