3-[1-(2,6-dimethoxyphenyl)-1,5-bis(oxidanylidene)-5-phenyl-pentan-3-yl]benzoic acid

Systemtic Name: 3-[1-(2,6-dimethoxyphenyl)-1,5-bis(oxidanylidene)-5-phenyl-pentan-3-yl]benzoic acid Openeye Name: 3-[1-[2-(2,6-dimethoxyphenyl)-2-oxo-ethyl]-3-oxo-3-phenyl-propyl]benzoic acid CAS Name: 3-[1-(2,6-dimethoxyphenyl)-1,5-dioxo-5-phenylpentan-3-yl]benzoic acid IUPAC Name: 3-[1-(2,6-dimethoxyphenyl)-1,5-dioxo-5-phenylpentan-3-yl]benzoic acid Traditional Name: 3-[1-[2-(2,6-dimethoxyphenyl)-2-keto-ethyl]-3-keto-3-phenyl-propyl]benzoic acid Formula: C26H24O6 MolecularWeight: 432.46516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)CC(CC(=O)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)CC(CC(=O)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C26H24O6/c1-31-23-12-7-13-24(32-2)25(23)22(28)16-20(15-21(27)17-8-4-3-5-9-17)18-10-6-11-19(14-18)26(29)30/h3-14,20H,15-16H2,1-2H3,(H,29,30)