2-acetyloxypropane-1,2,3-tricarboxylic acid; propan-2-one

Systemtic Name: 2-acetyloxypropane-1,2,3-tricarboxylic acid; propan-2-one Openeye Name: acetone; 2-acetoxypropane-1,2,3-tricarboxylic acid CAS Name: 2-acetyloxypropane-1,2,3-tricarboxylic acid; 2-propanone IUPAC Name: 2-acetyloxypropane-1,2,3-tricarboxylic acid; propan-2-one Traditional Name: acetone; 2-acetoxypropane-1,2,3-tricarboxylic acid Formula: C11H16O9 MolecularWeight: 292.23934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.CC(=O)OC(CC(=O)O)(CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C.CC(=O)OC(CC(=O)O)(CC(=O)O)C(=O)O

InChI

InChI=1S/C8H10O8.C3H6O/c1-4(9)16-8(7(14)15,2-5(10)11)3-6(12)13;1-3(2)4/h2-3H2,1H3,(H,10,11)(H,12,13)(H,14,15);1-2H3