2-azanylbutanedioic acid; 1H-benzimidazole; nickel

Systemtic Name: 2-azanylbutanedioic acid; 1H-benzimidazole; nickel Openeye Name: 2-aminobutanedioic acid; benzimidazole; nickel CAS Name: 2-aminobutanedioic acid; 1H-benzimidazole; nickel IUPAC Name: 2-aminobutanedioic acid; 1H-benzimidazole; nickel Traditional Name: 2-aminosuccinic acid; benzimidazole; nickel Formula: C25H25N7NiO4 MolecularWeight: 546.2039

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC=N2.C1=CC=C2C(=C1)NC=N2.C1=CC=C2C(=C1)NC=N2.C(C(C(=O)O)N)C(=O)O.[Ni]

Isomeric SMILES

C1=CC=C2C(=C1)NC=N2.C1=CC=C2C(=C1)NC=N2.C1=CC=C2C(=C1)NC=N2.C(C(C(=O)O)N)C(=O)O.[Ni]

InChI

InChI=1S/3C7H6N2.C4H7NO4.Ni/c3*1-2-4-7-6(3-1)8-5-9-7;5-2(4(8)9)1-3(6)7;/h3*1-5H,(H,8,9);2H,1,5H2,(H,6,7)(H,8,9);