6-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonyl-2-phenyl-1,4-dihydropyridazin-3-one

Systemtic Name: 6-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonyl-2-phenyl-1,4-dihydropyridazin-3-one Openeye Name: 6-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]-2-phenyl-1,4-dihydropyridazin-3-one CAS Name: 6-[[4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-2-phenyl-1,4-dihydropyridazin-3-one IUPAC Name: 6-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]-2-phenyl-1,4-dihydropyridazin-3-one Traditional Name: 6-[4-(4-fluorobenzyl)piperazin-4-ium-1-carbonyl]-2-phenyl-1,4-dihydropyridazin-3-one Formula: C22H24FN4O2+ MolecularWeight: 395.449963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C(=O)C3=CCC(=O)N(N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C(=O)C3=CCC(=O)N(N3)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN4O2/c23-18-8-6-17(7-9-18)16-25-12-14-26(15-13-25)22(29)20-10-11-21(28)27(24-20)19-4-2-1-3-5-19/h1-10,24H,11-16H2/p+1