6-methyl-3-octanoyl-oxane-2,4-dione

Systemtic Name: 6-methyl-3-octanoyl-oxane-2,4-dione Openeye Name: 6-methyl-3-octanoyl-tetrahydropyran-2,4-dione CAS Name: 6-methyl-3-(1-oxooctyl)oxane-2,4-dione IUPAC Name: 6-methyl-3-octanoyloxane-2,4-dione Traditional Name: 3-caprylyl-6-methyl-tetrahydropyran-2,4-quinone Formula: C14H22O4 MolecularWeight: 254.32208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1C(=O)CC(OC1=O)C

Isomeric SMILES

CCCCCCCC(=O)C1C(=O)CC(OC1=O)C

InChI

InChI=1S/C14H22O4/c1-3-4-5-6-7-8-11(15)13-12(16)9-10(2)18-14(13)17/h10,13H,3-9H2,1-2H3