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

Systemtic Name: 7,7-dimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione Openeye Name: 7,7-dimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione CAS Name: 7,7-dimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepin-2,6-dione IUPAC Name: 7,7-dimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepine-2,6-dione Traditional Name: 7,7-dimethyl-3,4,8,9-tetrahydro-1,5-benzodioxepin-2,6-quinone Formula: C11H14O4 MolecularWeight: 210.22646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1=O)OCCC(=O)O2)C

Isomeric SMILES

CC1(CCC2=C(C1=O)OCCC(=O)O2)C

InChI

InChI=1S/C11H14O4/c1-11(2)5-3-7-9(10(11)13)14-6-4-8(12)15-7/h3-6H2,1-2H3