butane; 3-nonoxy-3-oxidanylidene-propanoate

Systemtic Name: butane; 3-nonoxy-3-oxidanylidene-propanoate Openeye Name: butane; 3-nonoxy-3-oxo-propanoate CAS Name: butane; 3-nonoxy-3-oxopropanoate IUPAC Name: butane; 3-nonoxy-3-oxopropanoate Traditional Name: 3-keto-3-nonoxy-propionate; n-butane Formula: C16H31O4- MolecularWeight: 287.41494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCCCCCCCOC(=O)CC(=O)[O-]

Isomeric SMILES

CCCC.CCCCCCCCCOC(=O)CC(=O)[O-]

InChI

InChI=1S/C12H22O4.C4H10/c1-2-3-4-5-6-7-8-9-16-12(15)10-11(13)14;1-3-4-2/h2-10H2,1H3,(H,13,14);3-4H2,1-2H3/p-1