ethanoic acid; ethyl 4-oxidanylbutanoate

Systemtic Name: ethanoic acid; ethyl 4-oxidanylbutanoate Openeye Name: acetic acid; ethyl 4-hydroxybutanoate CAS Name: acetic acid; 4-hydroxybutanoic acid ethyl ester IUPAC Name: acetic acid; ethyl 4-hydroxybutanoate Traditional Name: acetic acid; 4-hydroxybutyric acid ethyl ester Formula: C22H44O19 MolecularWeight: 612.57336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCO.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)CCCO.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/C6H12O3.8C2H4O2/c1-2-9-6(8)4-3-5-7;8*1-2(3)4/h7H,2-5H2,1H3;8*1H3,(H,3,4)