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calcium 2-(dioxidanyl)-3-oxidanyl-benzoate

calcium 2-(dioxidanyl)-3-oxidanyl-benzoate

Systemtic Name:calcium 2-(dioxidanyl)-3-oxidanyl-benzoate
Openeye Name:calcium 2-hydroperoxy-3-hydroxy-benzoate
CAS Name:calcium 2-hydroperoxy-3-hydroxybenzoate
IUPAC Name:calcium 2-hydroperoxy-3-hydroxybenzoate
Traditional Name:calcium 2-hydroperoxy-3-hydroxy-benzoate
Formula: C14H10CaO10
MolecularWeight: 378.3012
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)O)OO)C(=O)[O-].C1=CC(=C(C(=C1)O)OO)C(=O)[O-].[Ca+2]


Isomeric SMILES

C1=CC(=C(C(=C1)O)OO)C(=O)[O-].C1=CC(=C(C(=C1)O)OO)C(=O)[O-].[Ca+2]


InChI

InChI=1S/2C7H6O5.Ca/c2*8-5-3-1-2-4(7(9)10)6(5)12-11;/h2*1-3,8,11H,(H,9,10);/q;;+2/p-2


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