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

Systemtic Name: 2-[1-(4-bromophenyl)-2-oxidanylidene-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[1-(4-bromophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[1-(4-bromophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)-3-azetidinyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[1-(4-bromophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[1-(4-bromophenyl)-2-keto-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-4-nitro-isoindoline-1,3-quinone Formula: C26H20BrN3O8 MolecularWeight: 582.3563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(C(=O)N2C3=CC=C(C=C3)Br)N4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2C(C(=O)N2C3=CC=C(C=C3)Br)N4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H20BrN3O8/c1-36-18-11-13(12-19(37-2)23(18)38-3)21-22(26(33)28(21)15-9-7-14(27)8-10-15)29-24(31)16-5-4-6-17(30(34)35)20(16)25(29)32/h4-12,21-22H,1-3H3