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

Systemtic Name: 3-[2-chloranyl-5-[(6-oxidanylidene-1H-pyridazin-3-yl)methyl]phenoxy]-5-fluoranyl-benzoic acid Openeye Name: 3-[2-chloro-5-[(6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]-5-fluoro-benzoic acid CAS Name: 3-[2-chloro-5-[(6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]-5-fluorobenzoic acid IUPAC Name: 3-[2-chloro-5-[(6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]-5-fluorobenzoic acid Traditional Name: 3-[2-chloro-5-[(6-keto-1H-pyridazin-3-yl)methyl]phenoxy]-5-fluoro-benzoic acid Formula: C18H12ClFN2O4 MolecularWeight: 374.750283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=NNC(=O)C=C2)OC3=CC(=CC(=C3)C(=O)O)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1CC2=NNC(=O)C=C2)OC3=CC(=CC(=C3)C(=O)O)F)Cl

InChI

InChI=1S/C18H12ClFN2O4/c19-15-3-1-10(5-13-2-4-17(23)22-21-13)6-16(15)26-14-8-11(18(24)25)7-12(20)9-14/h1-4,6-9H,5H2,(H,22,23)(H,24,25)