3-(3,5-dimethoxyphenyl)-6,7-dimethoxy-4-(trifluoromethyl)isochromen-1-one

Systemtic Name: 3-(3,5-dimethoxyphenyl)-6,7-dimethoxy-4-(trifluoromethyl)isochromen-1-one Openeye Name: 3-(3,5-dimethoxyphenyl)-6,7-dimethoxy-4-(trifluoromethyl)isochromen-1-one CAS Name: 3-(3,5-dimethoxyphenyl)-6,7-dimethoxy-4-(trifluoromethyl)-2-benzopyran-1-one IUPAC Name: 3-(3,5-dimethoxyphenyl)-6,7-dimethoxy-4-(trifluoromethyl)isochromen-1-one Traditional Name: 3-(3,5-dimethoxyphenyl)-6,7-dimethoxy-4-(trifluoromethyl)isocoumarin Formula: C20H17F3O6 MolecularWeight: 410.34059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=C(C3=CC(=C(C=C3C(=O)O2)OC)OC)C(F)(F)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=C(C3=CC(=C(C=C3C(=O)O2)OC)OC)C(F)(F)F)OC

InChI

InChI=1S/C20H17F3O6/c1-25-11-5-10(6-12(7-11)26-2)18-17(20(21,22)23)13-8-15(27-3)16(28-4)9-14(13)19(24)29-18/h5-9H,1-4H3