2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxopropyl]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-5-phenyl-cyclohexane-1,3-quinone Formula: C23H22O5 MolecularWeight: 378.41778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCC(=O)C3C(=O)CC(CC3=O)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCC(=O)C3C(=O)CC(CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22O5/c24-18(8-6-15-7-9-21-22(12-15)28-11-10-27-21)23-19(25)13-17(14-20(23)26)16-4-2-1-3-5-16/h1-5,7,9,12,17,23H,6,8,10-11,13-14H2