aluminum; 2-methyl-4-oxidanylidene-pyran-3-olate; 2-methyl-3-oxidanyl-pyran-4-one

Systemtic Name: aluminum; 2-methyl-4-oxidanylidene-pyran-3-olate; 2-methyl-3-oxidanyl-pyran-4-one Openeye Name: aluminum; 3-hydroxy-2-methyl-pyran-4-one; 2-methyl-4-oxo-pyran-3-olate CAS Name: aluminum; 3-hydroxy-2-methyl-4-pyranone; 2-methyl-4-oxo-3-pyranolate IUPAC Name: aluminum; 3-hydroxy-2-methylpyran-4-one; 2-methyl-4-oxopyran-3-olate Traditional Name: aluminum; 3-hydroxy-2-methyl-pyran-4-one; 4-keto-2-methyl-pyran-3-olate Formula: C18H16AlO9+ MolecularWeight: 403.295778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=CO1)O.CC1=C(C(=O)C=CO1)[O-].CC1=C(C(=O)C=CO1)[O-].[Al+3]

Isomeric SMILES

CC1=C(C(=O)C=CO1)O.CC1=C(C(=O)C=CO1)[O-].CC1=C(C(=O)C=CO1)[O-].[Al+3]

InChI

InChI=1S/3C6H6O3.Al/c3*1-4-6(8)5(7)2-3-9-4;/h3*2-3,8H,1H3;/q;;;+3/p-2