5-[(4-fluorophenyl)methoxy]-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-1H-pyridin-4-one

Systemtic Name: 5-[(4-fluorophenyl)methoxy]-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-1H-pyridin-4-one Openeye Name: 5-[(4-fluorophenyl)methoxy]-2-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-1H-pyridin-4-one CAS Name: 5-[(4-fluorophenyl)methoxy]-2-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-1H-pyridin-4-one IUPAC Name: 5-[(4-fluorophenyl)methoxy]-2-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-1H-pyridin-4-one Traditional Name: 5-(4-fluorobenzyl)oxy-2-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-4-pyridone Formula: C22H22FN4O3+ MolecularWeight: 409.433483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=O)C(=CN3)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=O)C(=CN3)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN4O3/c23-17-6-4-16(5-7-17)15-30-20-14-25-18(13-19(20)28)22(29)27-11-9-26(10-12-27)21-3-1-2-8-24-21/h1-8,13-14H,9-12,15H2,(H,25,28)/p+1