aluminum 2-(dioxidanyl)-2,3,4,5,6-pentakis(oxidanyl)hexanoate

Systemtic Name: aluminum 2-(dioxidanyl)-2,3,4,5,6-pentakis(oxidanyl)hexanoate Openeye Name: aluminum 2-hydroperoxy-2,3,4,5,6-pentahydroxy-hexanoate CAS Name: aluminum 2-hydroperoxy-2,3,4,5,6-pentahydroxyhexanoate IUPAC Name: aluminum 2-hydroperoxy-2,3,4,5,6-pentahydroxyhexanoate Traditional Name: aluminum 2-hydroperoxy-2,3,4,5,6-pentahydroxy-hexanoate Formula: C18H33AlO27 MolecularWeight: 708.419958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C6H12O9.Al/c3*7-1-2(8)3(9)4(10)6(13,15-14)5(11)12;/h3*2-4,7-10,13-14H,1H2,(H,11,12);/q;;;+3/p-3