barium(2+); 2,2,6,6-tetramethyl-5-oxidanylidene-hept-3-en-3-olate

Systemtic Name: barium(2+); 2,2,6,6-tetramethyl-5-oxidanylidene-hept-3-en-3-olate Openeye Name: barium(2+); 2,2,6,6-tetramethyl-5-oxo-hept-3-en-3-olate CAS Name: barium(2+); 2,2,6,6-tetramethyl-5-oxo-3-hepten-3-olate IUPAC Name: barium(2+); 2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate Traditional Name: barium(2+); 5-keto-2,2,6,6-tetramethyl-hept-3-en-3-olate Formula: C22H38BaO4 MolecularWeight: 503.86172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].[Ba+2]

Isomeric SMILES

CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].[Ba+2]

InChI

InChI=1S/2C11H20O2.Ba/c2*1-10(2,3)8(12)7-9(13)11(4,5)6;/h2*7,12H,1-6H3;/q;;+2/p-2