5-(dioxidanylmethyl)-2,4-bis[(3-ethyloxetan-3-yl)methoxycarbonyl]benzoic acid

Systemtic Name: 5-(dioxidanylmethyl)-2,4-bis[(3-ethyloxetan-3-yl)methoxycarbonyl]benzoic acid Openeye Name: 2,4-bis[(3-ethyloxetan-3-yl)methoxycarbonyl]-5-(hydroperoxymethyl)benzoic acid CAS Name: 2,4-bis[(3-ethyl-3-oxetanyl)methoxy-oxomethyl]-5-(hydroperoxymethyl)benzoic acid IUPAC Name: 2,4-bis[(3-ethyloxetan-3-yl)methoxycarbonyl]-5-(hydroperoxymethyl)benzoic acid Traditional Name: 2,4-bis[(3-ethyloxetan-3-yl)methoxycarbonyl]-5-(hydroperoxymethyl)benzoic acid Formula: C22H28O10 MolecularWeight: 452.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(COC1)COC(=O)C2=CC(=C(C=C2C(=O)O)COO)C(=O)OCC3(COC3)CC

Isomeric SMILES

CCC1(COC1)COC(=O)C2=CC(=C(C=C2C(=O)O)COO)C(=O)OCC3(COC3)CC

InChI

InChI=1S/C22H28O10/c1-3-21(8-28-9-21)12-30-19(25)15-6-17(16(18(23)24)5-14(15)7-32-27)20(26)31-13-22(4-2)10-29-11-22/h5-6,27H,3-4,7-13H2,1-2H3,(H,23,24)