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

Systemtic Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-4-[(E)-2-(3-nitrophenyl)ethenyl]isochromen-1-one Openeye Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-4-[(E)-2-(3-nitrophenyl)vinyl]isochromen-1-one CAS Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-4-[(E)-2-(3-nitrophenyl)ethenyl]-2-benzopyran-1-one IUPAC Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-4-[(E)-2-(3-nitrophenyl)ethenyl]isochromen-1-one Traditional Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-4-[(E)-2-(3-nitrophenyl)vinyl]isocoumarin Formula: C26H21NO7 MolecularWeight: 459.44744

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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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3C(=O)O2)OC)OC)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H21NO7/c1-31-19-10-8-17(9-11-19)25-20(12-7-16-5-4-6-18(13-16)27(29)30)21-14-23(32-2)24(33-3)15-22(21)26(28)34-25/h4-15H,1-3H3/b12-7+