4,7,7-trimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione

Systemtic Name: 4,7,7-trimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione Openeye Name: 4,7,7-trimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione CAS Name: 4,7,7-trimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepin-2,6-dione IUPAC Name: 4,7,7-trimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione Traditional Name: 4,7,7-trimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepin-2,6-quinone Formula: C12H16O4 MolecularWeight: 224.25304

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)OC2=C(O1)C(=O)C(CC2)(C)C

Isomeric SMILES

CC1CC(=O)OC2=C(O1)C(=O)C(CC2)(C)C

InChI

InChI=1S/C12H16O4/c1-7-6-9(13)16-8-4-5-12(2,3)11(14)10(8)15-7/h7H,4-6H2,1-3H3