carboxycarbonyl-[2-(carboxycarbonylazanidyl)-4-methyl-phenyl]azanide; nickel; tetramethylazanium; tetrahydrate

Systemtic Name: carboxycarbonyl-[2-(carboxycarbonylazanidyl)-4-methyl-phenyl]azanide; nickel; tetramethylazanium; tetrahydrate Openeye Name: (4-methyl-2-oxaloazanidyl-phenyl)-oxalo-azanide; nickel; tetramethylammonium; tetrahydrate CAS Name: (4-methyl-2-oxaloazanidylphenyl)-oxaloazanide; nickel; tetramethylammonium; tetrahydrate IUPAC Name: (4-methyl-2-oxaloazanidylphenyl)-oxaloazanide; nickel; tetramethylazanium; tetrahydrate Traditional Name: (4-methyl-2-oxaloazanidyl-phenyl)-oxalo-azanide; nickel; tetramethylammonium; tetrahydrate Formula: C19H40N4NiO10 MolecularWeight: 543.2351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N-]C(=O)C(=O)O)[N-]C(=O)C(=O)O.C[N+](C)(C)C.C[N+](C)(C)C.O.O.O.O.[Ni]

Isomeric SMILES

CC1=CC(=C(C=C1)[N-]C(=O)C(=O)O)[N-]C(=O)C(=O)O.C[N+](C)(C)C.C[N+](C)(C)C.O.O.O.O.[Ni]

InChI

InChI=1S/C11H10N2O6.2C4H12N.Ni.4H2O/c1-5-2-3-6(12-8(14)10(16)17)7(4-5)13-9(15)11(18)19;2*1-5(2,3)4;;;;;/h2-4H,1H3,(H4,12,13,14,15,16,17,18,19);2*1-4H3;;4*1H2/q;2*+1;;;;;/p-2