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

Systemtic Name: 2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxo-azetidin-3-yl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxo-3-azetidinyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-keto-azetidin-3-yl]-5-nitro-isoindoline-1,3-quinone Formula: C25H18BrN3O7 MolecularWeight: 552.33032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2C(C(=O)N2C3=CC=C(C=C3)Br)N4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2C(C(=O)N2C3=CC=C(C=C3)Br)N4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H18BrN3O7/c1-35-16-8-10-20(36-2)19(12-16)21-22(25(32)27(21)14-5-3-13(26)4-6-14)28-23(30)17-9-7-15(29(33)34)11-18(17)24(28)31/h3-12,21-22H,1-2H3