2-[2-(2,5-dimethoxyphenyl)-1-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(2,5-dimethoxyphenyl)-1-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(2,5-dimethoxyphenyl)-1-(3-fluoro-4-methyl-phenyl)-4-oxo-azetidin-3-yl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(2,5-dimethoxyphenyl)-1-(3-fluoro-4-methylphenyl)-4-oxo-3-azetidinyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(2,5-dimethoxyphenyl)-1-(3-fluoro-4-methylphenyl)-4-oxoazetidin-3-yl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(2,5-dimethoxyphenyl)-1-(3-fluoro-4-methyl-phenyl)-4-keto-azetidin-3-yl]-5-nitro-isoindoline-1,3-quinone Formula: C26H20FN3O7 MolecularWeight: 505.451303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(C(C2=O)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C5=C(C=CC(=C5)OC)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(C(C2=O)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C5=C(C=CC(=C5)OC)OC)F

InChI

InChI=1S/C26H20FN3O7/c1-13-4-5-14(11-20(13)27)28-22(19-12-16(36-2)7-9-21(19)37-3)23(26(28)33)29-24(31)17-8-6-15(30(34)35)10-18(17)25(29)32/h4-12,22-23H,1-3H3