5-ethoxy-4-ethoxycarbonyl-2-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-ethoxy-4-ethoxycarbonyl-2-methyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-ethoxy-4-ethoxycarbonyl-2-methyl-5-oxo-pentanoic acid CAS Name: 5-ethoxy-4-ethoxycarbonyl-2-methyl-5-oxopentanoic acid IUPAC Name: 5-ethoxy-4-ethoxycarbonyl-2-methyl-5-oxopentanoic acid Traditional Name: 4-carbethoxy-5-ethoxy-5-keto-2-methyl-valeric acid Formula: C11H18O6 MolecularWeight: 246.25702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC(C)C(=O)O)C(=O)OCC

InChI

InChI=1S/C11H18O6/c1-4-16-10(14)8(11(15)17-5-2)6-7(3)9(12)13/h7-8H,4-6H2,1-3H3,(H,12,13)