tert-butyl 3-oxidanylideneoctanoate

Systemtic Name: tert-butyl 3-oxidanylideneoctanoate Openeye Name: tert-butyl 3-oxooctanoate CAS Name: 3-oxooctanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxooctanoate Traditional Name: 3-ketocaprylic acid tert-butyl ester Formula: C12H22O3 MolecularWeight: 214.30128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC(=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C12H22O3/c1-5-6-7-8-10(13)9-11(14)15-12(2,3)4/h5-9H2,1-4H3