nickel(2+); 3-(4-oxidanylidene-1H-pyrimidin-6-yl)benzenecarbonitrile

Systemtic Name: nickel(2+); 3-(4-oxidanylidene-1H-pyrimidin-6-yl)benzenecarbonitrile Openeye Name: nickelous 3-(4-oxo-1H-pyrimidin-6-yl)benzonitrile CAS Name: nickel(2+); 3-(4-oxo-1H-pyrimidin-6-yl)benzonitrile IUPAC Name: nickel(2+); 3-(4-oxo-1H-pyrimidin-6-yl)benzonitrile Traditional Name: nickelous 3-(4-keto-1H-pyrimidin-6-yl)benzonitrile Formula: C11H7N3NiO+2 MolecularWeight: 255.88618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CC(=O)N=CN2)C#N.[Ni+2]

Isomeric SMILES

C1=CC(=CC(=C1)C2=CC(=O)N=CN2)C#N.[Ni+2]

InChI

InChI=1S/C11H7N3O.Ni/c12-6-8-2-1-3-9(4-8)10-5-11(15)14-7-13-10;/h1-5,7H,(H,13,14,15);/q;+2