nickel(2+); [(1-oxidaniumyl-3-oxidanylidene-inden-2-yl)-phenyl-methyl]-phenyl-azanide

Systemtic Name: nickel(2+); [(1-oxidaniumyl-3-oxidanylidene-inden-2-yl)-phenyl-methyl]-phenyl-azanide Openeye Name: nickelous [(1-oxo-3-oxonio-inden-2-yl)-phenyl-methyl]-phenyl-azanide CAS Name: nickel(2+); [(1-oxo-3-oxonio-2-indenyl)-phenylmethyl]-phenylazanide IUPAC Name: nickel(2+); [(1-oxo-3-oxonioinden-2-yl)-phenylmethyl]-phenylazanide Traditional Name: nickelous [(1-keto-3-oxonio-inden-2-yl)-phenyl-methyl]-phenyl-azanide Formula: C44H34N2NiO4+2 MolecularWeight: 713.44516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3C2=O)[OH2+])[N-]C4=CC=CC=C4.C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3C2=O)[OH2+])[N-]C4=CC=CC=C4.[Ni+2]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3C2=O)[OH2+])[N-]C4=CC=CC=C4.C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3C2=O)[OH2+])[N-]C4=CC=CC=C4.[Ni+2]

InChI

InChI=1S/2C22H16NO2.Ni/c2*24-21-17-13-7-8-14-18(17)22(25)19(21)20(15-9-3-1-4-10-15)23-16-11-5-2-6-12-16;/h2*1-14,20H,(H,24,25);/q2*-1;+2/p+2