aluminum; 3-oxidanylidenehexanoate; (Z)-4-oxidanylidenepent-2-en-2-olate

Systemtic Name: aluminum; 3-oxidanylidenehexanoate; (Z)-4-oxidanylidenepent-2-en-2-olate Openeye Name: aluminum; 3-oxohexanoate; (Z)-4-oxopent-2-en-2-olate CAS Name: aluminum; 3-oxohexanoate; (Z)-4-oxo-2-penten-2-olate IUPAC Name: aluminum; 3-oxohexanoate; (Z)-4-oxopent-2-en-2-olate Traditional Name: aluminum; 3-ketohexanoate; (Z)-4-ketopent-2-en-2-olate Formula: C16H23AlO7 MolecularWeight: 354.331158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CC(=O)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Al+3]

Isomeric SMILES

CCCC(=O)CC(=O)[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Al+3]

InChI

InChI=1S/C6H10O3.2C5H8O2.Al/c1-2-3-5(7)4-6(8)9;2*1-4(6)3-5(2)7;/h2-4H2,1H3,(H,8,9);2*3,6H,1-2H3;/q;;;+3/p-3/b;2*4-3-;