6-[2-(3,5-dimethoxyphenyl)ethynyl]-2,3-dimethoxy-xanthen-9-one

Systemtic Name: 6-[2-(3,5-dimethoxyphenyl)ethynyl]-2,3-dimethoxy-xanthen-9-one Openeye Name: 6-[2-(3,5-dimethoxyphenyl)ethynyl]-2,3-dimethoxy-xanthen-9-one CAS Name: 6-[2-(3,5-dimethoxyphenyl)ethynyl]-2,3-dimethoxy-9-xanthenone IUPAC Name: 6-[2-(3,5-dimethoxyphenyl)ethynyl]-2,3-dimethoxyxanthen-9-one Traditional Name: 6-[2-(3,5-dimethoxyphenyl)ethynyl]-2,3-dimethoxy-xanthone Formula: C25H20O6 MolecularWeight: 416.4227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C#CC2=CC3=C(C=C2)C(=O)C4=CC(=C(C=C4O3)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C#CC2=CC3=C(C=C2)C(=O)C4=CC(=C(C=C4O3)OC)OC)OC

InChI

InChI=1S/C25H20O6/c1-27-17-9-16(10-18(12-17)28-2)6-5-15-7-8-19-21(11-15)31-22-14-24(30-4)23(29-3)13-20(22)25(19)26/h7-14H,1-4H3