2-[3-(3-methoxy-2-oxidanyl-phenyl)propanoyl]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[3-(3-methoxy-2-oxidanyl-phenyl)propanoyl]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[3-(2-hydroxy-3-methoxy-phenyl)propanoyl]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[3-(2-hydroxy-3-methoxyphenyl)-1-oxopropyl]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[3-(2-hydroxy-3-methoxyphenyl)propanoyl]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[3-(2-hydroxy-3-methoxy-phenyl)propanoyl]-5-phenyl-cyclohexane-1,3-quinone Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)CCC(=O)C2C(=O)CC(CC2=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1O)CCC(=O)C2C(=O)CC(CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22O5/c1-27-20-9-5-8-15(22(20)26)10-11-17(23)21-18(24)12-16(13-19(21)25)14-6-3-2-4-7-14/h2-9,16,21,26H,10-13H2,1H3