3-[1,3-diethoxy-1,3-bis(oxidanylidene)propan-2-yl]oxycarbonyl-5-octoxy-3-oxidanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-[1,3-diethoxy-1,3-bis(oxidanylidene)propan-2-yl]oxycarbonyl-5-octoxy-3-oxidanyl-5-oxidanylidene-pentanoic acid Openeye Name: 3-(2-ethoxy-1-ethoxycarbonyl-2-oxo-ethoxy)carbonyl-3-hydroxy-5-octoxy-5-oxo-pentanoic acid CAS Name: 3-[(1,3-diethoxy-1,3-dioxopropan-2-yl)oxy-oxomethyl]-3-hydroxy-5-octoxy-5-oxopentanoic acid IUPAC Name: 3-(1,3-diethoxy-1,3-dioxopropan-2-yl)oxycarbonyl-3-hydroxy-5-octoxy-5-oxopentanoic acid Traditional Name: 3-(1-carbethoxy-2-ethoxy-2-keto-ethoxy)carbonyl-3-hydroxy-5-keto-5-octoxy-valeric acid Formula: C21H34O11 MolecularWeight: 462.48806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CC(CC(=O)O)(C(=O)OC(C(=O)OCC)C(=O)OCC)O

Isomeric SMILES

CCCCCCCCOC(=O)CC(CC(=O)O)(C(=O)OC(C(=O)OCC)C(=O)OCC)O

InChI

InChI=1S/C21H34O11/c1-4-7-8-9-10-11-12-31-16(24)14-21(28,13-15(22)23)20(27)32-17(18(25)29-5-2)19(26)30-6-3/h17,28H,4-14H2,1-3H3,(H,22,23)