calcium 2-(1,4-dioxaspiro[4.5]decan-3-yl)-2-oxidanyl-ethanoate

Systemtic Name: calcium 2-(1,4-dioxaspiro[4.5]decan-3-yl)-2-oxidanyl-ethanoate Openeye Name: calcium 2-(1,4-dioxaspiro[4.5]decan-3-yl)-2-hydroxy-acetate CAS Name: calcium 2-(1,4-dioxaspiro[4.5]decan-3-yl)-2-hydroxyacetate IUPAC Name: calcium 2-(1,4-dioxaspiro[4.5]decan-3-yl)-2-hydroxyacetate Traditional Name: calcium 2-(1,4-dioxaspiro[4.5]decan-3-yl)-2-hydroxy-acetate Formula: C20H30CaO10 MolecularWeight: 470.5242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OCC(O2)C(C(=O)[O-])O.C1CCC2(CC1)OCC(O2)C(C(=O)[O-])O.[Ca+2]

Isomeric SMILES

C1CCC2(CC1)OCC(O2)C(C(=O)[O-])O.C1CCC2(CC1)OCC(O2)C(C(=O)[O-])O.[Ca+2]

InChI

InChI=1S/2C10H16O5.Ca/c2*11-8(9(12)13)7-6-14-10(15-7)4-2-1-3-5-10;/h2*7-8,11H,1-6H2,(H,12,13);/q;;+2/p-2