2-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]ethanenitrile

Systemtic Name: 2-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]ethanenitrile Openeye Name: 2-[3-(4-bromophenyl)-6-oxo-pyridazin-1-yl]acetonitrile CAS Name: 2-[3-(4-bromophenyl)-6-oxo-1-pyridazinyl]acetonitrile IUPAC Name: 2-[3-(4-bromophenyl)-6-oxopyridazin-1-yl]acetonitrile Traditional Name: 2-[3-(4-bromophenyl)-6-keto-pyridazin-1-yl]acetonitrile Formula: C12H8BrN3O MolecularWeight: 290.11542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CC#N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CC#N)Br

InChI

InChI=1S/C12H8BrN3O/c13-10-3-1-9(2-4-10)11-5-6-12(17)16(15-11)8-7-14/h1-6H,8H2