methyl 2-oxidanylideneoctanoate

Systemtic Name: methyl 2-oxidanylideneoctanoate Openeye Name: methyl 2-oxooctanoate CAS Name: 2-oxooctanoic acid methyl ester IUPAC Name: methyl 2-oxooctanoate Traditional Name: 2-ketocaprylic acid methyl ester Formula: C9H16O3 MolecularWeight: 172.22154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C(=O)OC

Isomeric SMILES

CCCCCCC(=O)C(=O)OC

InChI

InChI=1S/C9H16O3/c1-3-4-5-6-7-8(10)9(11)12-2/h3-7H2,1-2H3