1-(4-fluorophenyl)-2-oxidanyl-7-phenyl-3-propan-2-yl-pyrimido[1,2-b]pyridazin-5-ium-4-one

Systemtic Name: 1-(4-fluorophenyl)-2-oxidanyl-7-phenyl-3-propan-2-yl-pyrimido[1,2-b]pyridazin-5-ium-4-one Openeye Name: 1-(4-fluorophenyl)-2-hydroxy-3-isopropyl-7-phenyl-pyrimido[1,2-b]pyridazin-5-ium-4-one CAS Name: 1-(4-fluorophenyl)-2-hydroxy-7-phenyl-3-propan-2-yl-4-pyrimido[1,2-b]pyridazin-5-iumone IUPAC Name: 1-(4-fluorophenyl)-2-hydroxy-7-phenyl-3-propan-2-ylpyrimido[1,2-b]pyridazin-5-ium-4-one Traditional Name: 1-(4-fluorophenyl)-2-hydroxy-3-isopropyl-7-phenyl-pyrimido[1,2-b]pyridazin-5-ium-4-one Formula: C22H19FN3O2+ MolecularWeight: 376.403563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C2=[N+](C1=O)N=C(C=C2)C3=CC=CC=C3)C4=CC=C(C=C4)F)O

Isomeric SMILES

CC(C)C1=C(N(C2=[N+](C1=O)N=C(C=C2)C3=CC=CC=C3)C4=CC=C(C=C4)F)O

InChI

InChI=1S/C22H18FN3O2/c1-14(2)20-21(27)25(17-10-8-16(23)9-11-17)19-13-12-18(24-26(19)22(20)28)15-6-4-3-5-7-15/h3-14H,1-2H3/p+1