bicyclo[3.1.1]hepta-1(6),2,4-triene; pentane-2,4-dione

Systemtic Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; pentane-2,4-dione Openeye Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; pentane-2,4-dione CAS Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; pentane-2,4-dione IUPAC Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; pentane-2,4-dione Traditional Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; pentane-2,4-dione Formula: C12H14O2 MolecularWeight: 190.23836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C.C1C2=CC1=CC=C2

Isomeric SMILES

CC(=O)CC(=O)C.C1C2=CC1=CC=C2

InChI

InChI=1S/C7H6.C5H8O2/c1-2-6-4-7(3-1)5-6;1-4(6)3-5(2)7/h1-4H,5H2;3H2,1-2H3