4-(3-fluoranyl-5-methoxy-phenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one

Systemtic Name: 4-(3-fluoranyl-5-methoxy-phenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one Openeye Name: 4-(3-fluoro-5-methoxy-phenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one CAS Name: 4-(3-fluoro-5-methoxyphenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)-2-benzopyran-1-one IUPAC Name: 4-(3-fluoro-5-methoxyphenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one Traditional Name: 4-(3-fluoro-5-methoxy-phenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)isocoumarin Formula: C25H21FO6 MolecularWeight: 436.429043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3C(=O)O2)OC)OC)C4=CC(=CC(=C4)F)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3C(=O)O2)OC)OC)C4=CC(=CC(=C4)F)OC

InChI

InChI=1S/C25H21FO6/c1-28-17-7-5-14(6-8-17)24-23(15-9-16(26)11-18(10-15)29-2)19-12-21(30-3)22(31-4)13-20(19)25(27)32-24/h5-13H,1-4H3