5-[(4-fluorophenyl)methoxy]-1-methyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyridin-4-one

Systemtic Name: 5-[(4-fluorophenyl)methoxy]-1-methyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyridin-4-one Openeye Name: 2-(4-benzylpiperazin-4-ium-1-carbonyl)-5-[(4-fluorophenyl)methoxy]-1-methyl-pyridin-4-one CAS Name: 5-[(4-fluorophenyl)methoxy]-1-methyl-2-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-4-pyridinone IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-carbonyl)-5-[(4-fluorophenyl)methoxy]-1-methylpyridin-4-one Traditional Name: 2-(4-benzylpiperazin-4-ium-1-carbonyl)-5-(4-fluorobenzyl)oxy-1-methyl-4-pyridone Formula: C25H27FN3O3+ MolecularWeight: 436.498583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)OCC4=CC=C(C=C4)F

Isomeric SMILES

CN1C=C(C(=O)C=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O3/c1-27-17-24(32-18-20-7-9-21(26)10-8-20)23(30)15-22(27)25(31)29-13-11-28(12-14-29)16-19-5-3-2-4-6-19/h2-10,15,17H,11-14,16,18H2,1H3/p+1