calcium 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-oxidanyl-ethanoate dihydrate

Systemtic Name: calcium 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-oxidanyl-ethanoate dihydrate Openeye Name: calcium 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-hydroxy-acetate dihydrate CAS Name: calcium 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-hydroxyacetate dihydrate IUPAC Name: calcium 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-hydroxyacetate dihydrate Traditional Name: calcium 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-hydroxy-acetate dihydrate Formula: C7H15CaO7+ MolecularWeight: 251.2678

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C(C(=O)[O-])O)C.O.O.[Ca+2]

Isomeric SMILES

CC1(OCC(O1)C(C(=O)[O-])O)C.O.O.[Ca+2]

InChI

InChI=1S/C7H12O5.Ca.2H2O/c1-7(2)11-3-4(12-7)5(8)6(9)10;;;/h4-5,8H,3H2,1-2H3,(H,9,10);;2*1H2/q;+2;;/p-1