5-methyl-6-[(1E,3E)-6-oxidanylidenehepta-1,3-dienyl]-2-(trichloromethyl)-1,3-dioxan-4-one

Systemtic Name: 5-methyl-6-[(1E,3E)-6-oxidanylidenehepta-1,3-dienyl]-2-(trichloromethyl)-1,3-dioxan-4-one Openeye Name: 5-methyl-6-[(1E,3E)-6-oxohepta-1,3-dienyl]-2-(trichloromethyl)-1,3-dioxan-4-one CAS Name: 5-methyl-6-[(1E,3E)-6-oxohepta-1,3-dienyl]-2-(trichloromethyl)-1,3-dioxan-4-one IUPAC Name: 5-methyl-6-[(1E,3E)-6-oxohepta-1,3-dienyl]-2-(trichloromethyl)-1,3-dioxan-4-one Traditional Name: 6-[(1E,3E)-6-ketohepta-1,3-dienyl]-5-methyl-2-(trichloromethyl)-1,3-dioxan-4-one Formula: C13H15Cl3O4 MolecularWeight: 341.6148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(OC1=O)C(Cl)(Cl)Cl)C=CC=CCC(=O)C

Isomeric SMILES

CC1C(OC(OC1=O)C(Cl)(Cl)Cl)/C=C/C=C/CC(=O)C

InChI

InChI=1S/C13H15Cl3O4/c1-8(17)6-4-3-5-7-10-9(2)11(18)20-12(19-10)13(14,15)16/h3-5,7,9-10,12H,6H2,1-2H3/b4-3+,7-5+