6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(trifluoromethyl)phenyl]hexanamide

Systemtic Name: 6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(trifluoromethyl)phenyl]hexanamide Openeye Name: 6-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-[2-(trifluoromethyl)phenyl]hexanamide CAS Name: 6-(4-nitro-1,3-dioxo-2-isoindolyl)-N-[2-(trifluoromethyl)phenyl]hexanamide IUPAC Name: 6-(4-nitro-1,3-dioxoisoindol-2-yl)-N-[2-(trifluoromethyl)phenyl]hexanamide Traditional Name: 6-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-[2-(trifluoromethyl)phenyl]hexanamide Formula: C21H18F3N3O5 MolecularWeight: 449.37993

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18F3N3O5/c22-21(23,24)14-8-3-4-9-15(14)25-17(28)11-2-1-5-12-26-19(29)13-7-6-10-16(27(31)32)18(13)20(26)30/h3-4,6-10H,1-2,5,11-12H2,(H,25,28)