N-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(4-fluorophenyl)-4-nitro-benzamide

Systemtic Name: N-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(4-fluorophenyl)-4-nitro-benzamide Openeye Name: N-[(5-bromo-1,3-dioxo-isoindolin-2-yl)methyl]-N-(4-fluorophenyl)-4-nitro-benzamide CAS Name: N-[(5-bromo-1,3-dioxo-2-isoindolyl)methyl]-N-(4-fluorophenyl)-4-nitrobenzamide IUPAC Name: N-[(5-bromo-1,3-dioxoisoindol-2-yl)methyl]-N-(4-fluorophenyl)-4-nitrobenzamide Traditional Name: N-[(5-bromo-1,3-diketo-isoindolin-2-yl)methyl]-N-(4-fluorophenyl)-4-nitro-benzamide Formula: C22H13BrFN3O5 MolecularWeight: 498.258123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N(CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N(CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C22H13BrFN3O5/c23-14-3-10-18-19(11-14)22(30)26(21(18)29)12-25(16-8-4-15(24)5-9-16)20(28)13-1-6-17(7-2-13)27(31)32/h1-11H,12H2