[2-[N-(4-carboxyhepta-1,6-diyn-4-yl)-C-phenyl-carbonimidoyl]phenyl]-pyridin-2-ylcarbonyl-azanide; nickel

Systemtic Name: [2-[N-(4-carboxyhepta-1,6-diyn-4-yl)-C-phenyl-carbonimidoyl]phenyl]-pyridin-2-ylcarbonyl-azanide; nickel Openeye Name: [2-[N-(1-carboxy-1-prop-2-ynyl-but-3-ynyl)-C-phenyl-carbonimidoyl]phenyl]-(pyridine-2-carbonyl)azanide; nickel CAS Name: [2-[4-carboxyhepta-1,6-diyn-4-ylimino(phenyl)methyl]phenyl]-[oxo(2-pyridinyl)methyl]azanide; nickel IUPAC Name: [2-[N-(4-carboxyhepta-1,6-diyn-4-yl)-C-phenylcarbonimidoyl]phenyl]-(pyridine-2-carbonyl)azanide; nickel Traditional Name: [2-[N-(1-carboxy-1-propargyl-but-3-ynyl)-C-phenyl-carbonimidoyl]phenyl]-picolinoyl-azanide; nickel Formula: C27H20N3NiO3- MolecularWeight: 493.1594

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(CC#C)(C(=O)O)N=C(C1=CC=CC=C1)C2=CC=CC=C2[N-]C(=O)C3=CC=CC=N3.[Ni]

Isomeric SMILES

C#CCC(CC#C)(C(=O)O)N=C(C1=CC=CC=C1)C2=CC=CC=C2[N-]C(=O)C3=CC=CC=N3.[Ni]

InChI

InChI=1S/C27H21N3O3.Ni/c1-3-17-27(18-4-2,26(32)33)30-24(20-12-6-5-7-13-20)21-14-8-9-15-22(21)29-25(31)23-16-10-11-19-28-23;/h1-2,5-16,19H,17-18H2,(H2,29,30,31,32,33);/p-1