ethyl butanoate; 2-ethyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl butanoate; 2-ethyl-3-oxidanylidene-butanoate Openeye Name: ethyl butanoate; 2-ethyl-3-oxo-butanoate CAS Name: butanoic acid ethyl ester; 2-ethyl-3-oxobutanoate IUPAC Name: ethyl butanoate; 2-ethyl-3-oxobutanoate Traditional Name: butyric acid ethyl ester; 2-ethyl-3-keto-butyrate Formula: C12H21O5- MolecularWeight: 245.29214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC.CCC(C(=O)C)C(=O)[O-]

Isomeric SMILES

CCCC(=O)OCC.CCC(C(=O)C)C(=O)[O-]

InChI

InChI=1S/C6H10O3.C6H12O2/c1-3-5(4(2)7)6(8)9;1-3-5-6(7)8-4-2/h5H,3H2,1-2H3,(H,8,9);3-5H2,1-2H3/p-1