2-[3,4-bis(fluoranyl)phenyl]-5-bromanyl-4-(3-methyl-3-oxidanyl-butoxy)pyridazin-3-one

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-5-bromanyl-4-(3-methyl-3-oxidanyl-butoxy)pyridazin-3-one Openeye Name: 5-bromo-2-(3,4-difluorophenyl)-4-(3-hydroxy-3-methyl-butoxy)pyridazin-3-one CAS Name: 5-bromo-2-(3,4-difluorophenyl)-4-(3-hydroxy-3-methylbutoxy)-3-pyridazinone IUPAC Name: 5-bromo-2-(3,4-difluorophenyl)-4-(3-hydroxy-3-methylbutoxy)pyridazin-3-one Traditional Name: 5-bromo-2-(3,4-difluorophenyl)-4-(3-hydroxy-3-methyl-butoxy)pyridazin-3-one Formula: C15H15BrF2N2O3 MolecularWeight: 389.192006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOC1=C(C=NN(C1=O)C2=CC(=C(C=C2)F)F)Br)O

Isomeric SMILES

CC(C)(CCOC1=C(C=NN(C1=O)C2=CC(=C(C=C2)F)F)Br)O

InChI

InChI=1S/C15H15BrF2N2O3/c1-15(2,22)5-6-23-13-10(16)8-19-20(14(13)21)9-3-4-11(17)12(18)7-9/h3-4,7-8,22H,5-6H2,1-2H3