4-methylbicyclo[3.1.1]hepta-1(7),2,4-trien-6-one

Systemtic Name: 4-methylbicyclo[3.1.1]hepta-1(7),2,4-trien-6-one Openeye Name: 4-methylbicyclo[3.1.1]hepta-1(7),2,4-trien-6-one CAS Name: 4-methyl-6-bicyclo[3.1.1]hepta-1(7),2,4-trienone IUPAC Name: 4-methylbicyclo[3.1.1]hepta-1(7),2,4-trien-6-one Traditional Name: 4-methylbicyclo[3.1.1]hepta-1(7),2,4-trien-6-one Formula: C8H6O MolecularWeight: 118.13264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C2=O)C=C1

Isomeric SMILES

CC1=C2C=C(C2=O)C=C1

InChI

InChI=1S/C8H6O/c1-5-2-3-6-4-7(5)8(6)9/h2-4H,1H3