4,7,7-trimethyl-3,4,4a,6,8,8a-hexahydrochromene-2,5-dione

Systemtic Name: 4,7,7-trimethyl-3,4,4a,6,8,8a-hexahydrochromene-2,5-dione Openeye Name: 4,7,7-trimethyl-3,4,4a,6,8,8a-hexahydrochromene-2,5-dione CAS Name: 4,7,7-trimethyl-3,4,4a,6,8,8a-hexahydro-1-benzopyran-2,5-dione IUPAC Name: 4,7,7-trimethyl-3,4,4a,6,8,8a-hexahydrochromene-2,5-dione Traditional Name: 4,7,7-trimethyl-3,4,4a,6,8,8a-hexahydrochromene-2,5-quinone Formula: C12H18O3 MolecularWeight: 210.26952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)OC2C1C(=O)CC(C2)(C)C

Isomeric SMILES

CC1CC(=O)OC2C1C(=O)CC(C2)(C)C

InChI

InChI=1S/C12H18O3/c1-7-4-10(14)15-9-6-12(2,3)5-8(13)11(7)9/h7,9,11H,4-6H2,1-3H3