1-(2-chlorophenyl)-3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]carbonyl-6-methyl-pyridazin-4-one

Systemtic Name: 1-(2-chlorophenyl)-3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]carbonyl-6-methyl-pyridazin-4-one Openeye Name: 1-(2-chlorophenyl)-3-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-4-ium-1-carbonyl]-6-methyl-pyridazin-4-one CAS Name: 1-(2-chlorophenyl)-3-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-6-methyl-4-pyridazinone IUPAC Name: 1-(2-chlorophenyl)-3-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-6-methylpyridazin-4-one Traditional Name: 1-(2-chlorophenyl)-3-[4-(3-fluoro-4-methoxy-benzyl)piperazin-4-ium-1-carbonyl]-6-methyl-pyridazin-4-one Formula: C24H25ClFN4O3+ MolecularWeight: 471.931703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2Cl)C(=O)N3CC[NH+](CC3)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2Cl)C(=O)N3CC[NH+](CC3)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C24H24ClFN4O3/c1-16-13-21(31)23(27-30(16)20-6-4-3-5-18(20)25)24(32)29-11-9-28(10-12-29)15-17-7-8-22(33-2)19(26)14-17/h3-8,13-14H,9-12,15H2,1-2H3/p+1