butan-2-one; methoxymethane; propane-1,2-diol; ethanoate

Systemtic Name: butan-2-one; methoxymethane; propane-1,2-diol; ethanoate Openeye Name: butan-2-one; methoxymethane; propane-1,2-diol; acetate CAS Name: 2-butanone; methoxymethane; propane-1,2-diol; acetate IUPAC Name: butan-2-one; methoxymethane; propane-1,2-diol; acetate Traditional Name: butan-2-one; methoxymethane; propane-1,2-diol; acetate Formula: C11H25O6- MolecularWeight: 253.3126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C.CC(CO)O.CC(=O)[O-].COC

Isomeric SMILES

CCC(=O)C.CC(CO)O.CC(=O)[O-].COC

InChI

InChI=1S/C4H8O.C3H8O2.C2H4O2.C2H6O/c1-3-4(2)5;1-3(5)2-4;1-2(3)4;1-3-2/h3H2,1-2H3;3-5H,2H2,1H3;1H3,(H,3,4);1-2H3/p-1