2-(4-methoxyphenyl)cyclohexane-1,3-dione

Systemtic Name: 2-(4-methoxyphenyl)cyclohexane-1,3-dione Openeye Name: 2-(4-methoxyphenyl)cyclohexane-1,3-dione CAS Name: 2-(4-methoxyphenyl)cyclohexane-1,3-dione IUPAC Name: 2-(4-methoxyphenyl)cyclohexane-1,3-dione Traditional Name: 2-(4-methoxyphenyl)cyclohexane-1,3-quinone Formula: C13H14O3 MolecularWeight: 218.24846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=O)CCCC2=O

Isomeric SMILES

COC1=CC=C(C=C1)C2C(=O)CCCC2=O

InChI

InChI=1S/C13H14O3/c1-16-10-7-5-9(6-8-10)13-11(14)3-2-4-12(13)15/h5-8,13H,2-4H2,1H3