5-(3-methoxyphenyl)cyclohexane-1,3-dione

Systemtic Name: 5-(3-methoxyphenyl)cyclohexane-1,3-dione Openeye Name: 5-(3-methoxyphenyl)cyclohexane-1,3-dione CAS Name: 5-(3-methoxyphenyl)cyclohexane-1,3-dione IUPAC Name: 5-(3-methoxyphenyl)cyclohexane-1,3-dione Traditional Name: 5-(3-methoxyphenyl)cyclohexane-1,3-quinone Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CC(=O)CC(=O)C2

Isomeric SMILES

COC1=CC=CC(=C1)C2CC(=O)CC(=O)C2

InChI

InChI=1S/C13H14O3/c1-16-13-4-2-3-9(7-13)10-5-11(14)8-12(15)6-10/h2-4,7,10H,5-6,8H2,1H3