2-[2-(5-bromanyl-2-methoxy-phenyl)-1-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(5-bromanyl-2-methoxy-phenyl)-1-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-azetidin-3-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(5-bromo-2-methoxy-phenyl)-1-(3-chloro-4-methoxy-phenyl)-4-oxo-azetidin-3-yl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(5-bromo-2-methoxyphenyl)-1-(3-chloro-4-methoxyphenyl)-4-oxo-3-azetidinyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(5-bromo-2-methoxyphenyl)-1-(3-chloro-4-methoxyphenyl)-4-oxoazetidin-3-yl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(5-bromo-2-methoxy-phenyl)-1-(3-chloro-4-methoxy-phenyl)-4-keto-azetidin-3-yl]-5-nitro-isoindoline-1,3-quinone Formula: C25H17BrClN3O7 MolecularWeight: 586.77538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H17BrClN3O7/c1-36-19-7-3-12(26)9-17(19)21-22(25(33)28(21)13-5-8-20(37-2)18(27)11-13)29-23(31)15-6-4-14(30(34)35)10-16(15)24(29)32/h3-11,21-22H,1-2H3