2-[1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4,5-dimethyl-6-oxidanylidene-pyridazin-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4,5-dimethyl-6-oxidanylidene-pyridazin-3-yl]ethanoic acid Openeye Name: 2-[1-[(4-bromo-2-fluoro-phenyl)methyl]-4,5-dimethyl-6-oxo-pyridazin-3-yl]acetic acid CAS Name: 2-[1-[(4-bromo-2-fluorophenyl)methyl]-4,5-dimethyl-6-oxo-3-pyridazinyl]acetic acid IUPAC Name: 2-[1-[(4-bromo-2-fluorophenyl)methyl]-4,5-dimethyl-6-oxopyridazin-3-yl]acetic acid Traditional Name: 2-[1-(4-bromo-2-fluoro-benzyl)-6-keto-4,5-dimethyl-pyridazin-3-yl]acetic acid Formula: C15H14BrFN2O3 MolecularWeight: 369.185663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1CC(=O)O)CC2=C(C=C(C=C2)Br)F)C

Isomeric SMILES

CC1=C(C(=O)N(N=C1CC(=O)O)CC2=C(C=C(C=C2)Br)F)C

InChI

InChI=1S/C15H14BrFN2O3/c1-8-9(2)15(22)19(18-13(8)6-14(20)21)7-10-3-4-11(16)5-12(10)17/h3-5H,6-7H2,1-2H3,(H,20,21)