ethanoyl ethanoate; hexanedioic acid

Systemtic Name: ethanoyl ethanoate; hexanedioic acid Openeye Name: acetyl acetate; adipic acid CAS Name: acetic acid acetyl ester; hexanedioic acid IUPAC Name: acetyl acetate; hexanedioic acid Traditional Name: acetic acid acetyl ester; adipic acid Formula: C10H16O7 MolecularWeight: 248.22984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H10O4.C4H6O3/c7-5(8)3-1-2-4-6(9)10;1-3(5)7-4(2)6/h1-4H2,(H,7,8)(H,9,10);1-2H3