4-[(E)-2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one

Systemtic Name: 4-[(E)-2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one Openeye Name: 4-[(E)-2-(4-fluorophenyl)vinyl]-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one CAS Name: 4-[(E)-2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-(4-methoxyphenyl)-2-benzopyran-1-one IUPAC Name: 4-[(E)-2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-(4-methoxyphenyl)isochromen-1-one Traditional Name: 4-[(E)-2-(4-fluorophenyl)vinyl]-6,7-dimethoxy-3-(4-methoxyphenyl)isocoumarin Formula: C26H21FO5 MolecularWeight: 432.440343

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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)C=CC4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C26H21FO5/c1-29-19-11-7-17(8-12-19)25-20(13-6-16-4-9-18(27)10-5-16)21-14-23(30-2)24(31-3)15-22(21)26(28)32-25/h4-15H,1-3H3/b13-6+