ethanoic acid; ethyl 3-oxidanylpropanoate

Systemtic Name: ethanoic acid; ethyl 3-oxidanylpropanoate Openeye Name: acetic acid; ethyl 3-hydroxypropanoate CAS Name: acetic acid; 3-hydroxypropanoic acid ethyl ester IUPAC Name: acetic acid; ethyl 3-hydroxypropanoate Traditional Name: acetic acid; 3-hydroxypropionic acid ethyl ester Formula: C21H42O19 MolecularWeight: 598.54678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCO.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

Isomeric SMILES

CCOC(=O)CCO.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

InChI

InChI=1S/C5H10O3.8C2H4O2/c1-2-8-5(7)3-4-6;8*1-2(3)4/h6H,2-4H2,1H3;8*1H3,(H,3,4)