3-fluoranyl-5-[2-methyl-5-[(5-methyl-6-oxidanylidene-1H-pyridazin-3-yl)methyl]phenoxy]benzoic acid

Systemtic Name: 3-fluoranyl-5-[2-methyl-5-[(5-methyl-6-oxidanylidene-1H-pyridazin-3-yl)methyl]phenoxy]benzoic acid Openeye Name: 3-fluoro-5-[2-methyl-5-[(5-methyl-6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]benzoic acid CAS Name: 3-fluoro-5-[2-methyl-5-[(5-methyl-6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]benzoic acid IUPAC Name: 3-fluoro-5-[2-methyl-5-[(5-methyl-6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]benzoic acid Traditional Name: 3-fluoro-5-[5-[(6-keto-5-methyl-1H-pyridazin-3-yl)methyl]-2-methyl-phenoxy]benzoic acid Formula: C20H17FN2O4 MolecularWeight: 368.358383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=NNC(=O)C(=C2)C)OC3=CC(=CC(=C3)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=NNC(=O)C(=C2)C)OC3=CC(=CC(=C3)C(=O)O)F

InChI

InChI=1S/C20H17FN2O4/c1-11-3-4-13(6-16-5-12(2)19(24)23-22-16)7-18(11)27-17-9-14(20(25)26)8-15(21)10-17/h3-5,7-10H,6H2,1-2H3,(H,23,24)(H,25,26)