oxidanium; nickel; (8E)-5-oxidanylidene-8-(pyridin-2-ylhydrazinylidene)quinoline-3-carboxylate; quinolin-8-ol

Systemtic Name: oxidanium; nickel; (8E)-5-oxidanylidene-8-(pyridin-2-ylhydrazinylidene)quinoline-3-carboxylate; quinolin-8-ol Openeye Name: oxonium; nickel; (8E)-5-oxo-8-(2-pyridylhydrazono)quinoline-3-carboxylate; quinolin-8-ol CAS Name: oxonium; nickel; (8E)-5-oxo-8-(2-pyridinylhydrazinylidene)-3-quinolinecarboxylate; 8-quinolinol IUPAC Name: oxidanium; nickel; (8E)-5-oxo-8-(pyridin-2-ylhydrazinylidene)quinoline-3-carboxylate; quinolin-8-ol Traditional Name: oxonium; (8E)-5-keto-8-(2-pyridylhydrazono)quinoline-3-carboxylate; nickel; oxine Formula: C24H19N5NiO5 MolecularWeight: 516.13156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NN=C2C=CC(=O)C3=CC(=CN=C23)C(=O)[O-].C1=CC2=C(C(=C1)O)N=CC=C2.[OH3+].[Ni]

Isomeric SMILES

C1=CC=NC(=C1)N/N=C/2\C=CC(=O)C3=CC(=CN=C23)C(=O)[O-].C1=CC2=C(C(=C1)O)N=CC=C2.[OH3+].[Ni]

InChI

InChI=1S/C15H10N4O3.C9H7NO.Ni.H2O/c20-12-5-4-11(18-19-13-3-1-2-6-16-13)14-10(12)7-9(8-17-14)15(21)22;11-8-5-1-3-7-4-2-6-10-9(7)8;;/h1-8H,(H,16,19)(H,21,22);1-6,11H;;1H2/b18-11+;;;