cyclohexene; 2-ethylhexanoate; nickel(2+); triethylalumane

Systemtic Name: cyclohexene; 2-ethylhexanoate; nickel(2+); triethylalumane Openeye Name: nickelous; cyclohexene; 2-ethylhexanoate; triethylalumane CAS Name: cyclohexene; 2-ethylhexanoate; nickel(2+); triethylalumane IUPAC Name: cyclohexene; 2-ethylhexanoate; nickel(2+); triethylalumane Traditional Name: nickelous; cyclohexene; 2-ethylhexanoate; triethylalumane Formula: C28H55AlNiO4 MolecularWeight: 541.408838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CC[Al](CC)CC.C1CCC=CC1.[Ni+2]

Isomeric SMILES

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CC[Al](CC)CC.C1CCC=CC1.[Ni+2]

InChI

InChI=1S/2C8H16O2.C6H10.3C2H5.Al.Ni/c2*1-3-5-6-7(4-2)8(9)10;1-2-4-6-5-3-1;3*1-2;;/h2*7H,3-6H2,1-2H3,(H,9,10);1-2H,3-6H2;3*1H2,2H3;;/q;;;;;;;+2/p-2