(3,5-dimethyl-2-oxidanyl-phenyl)carbonyloxyaluminum(1+) hydrate

Systemtic Name: (3,5-dimethyl-2-oxidanyl-phenyl)carbonyloxyaluminum(1+) hydrate Openeye Name: (2-hydroxy-3,5-dimethyl-benzoyl)oxyaluminum(1+) hydrate CAS Name: [(2-hydroxy-3,5-dimethylphenyl)-oxomethoxy]aluminum(1+) hydrate IUPAC Name: (2-hydroxy-3,5-dimethylbenzoyl)oxyaluminum(1+) hydrate Traditional Name: (2-hydroxy-3,5-dimethyl-benzoyl)oxyaluminum(1+) hydrate Formula: C9H11AlO4+ MolecularWeight: 210.162778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O[Al+])O)C.O

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O[Al+])O)C.O

InChI

InChI=1S/C9H10O3.Al.H2O/c1-5-3-6(2)8(10)7(4-5)9(11)12;;/h3-4,10H,1-2H3,(H,11,12);;1H2/q;+2;/p-1