2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(4-bromo-2-fluoro-phenyl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(4-bromo-2-fluorophenyl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(4-bromo-2-fluorophenyl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-(4-bromo-2-fluoro-benzyl)-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C14H11BrFN3O MolecularWeight: 336.159043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=C(C=C(C=C2)Br)F)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=C(C=C(C=C2)Br)F)C#N

InChI

InChI=1S/C14H11BrFN3O/c1-8-9(2)18-19(14(20)12(8)6-17)7-10-3-4-11(15)5-13(10)16/h3-5H,7H2,1-2H3