5-nitro-2-[[2-(trifluoromethyl)phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 5-nitro-2-[[2-(trifluoromethyl)phenyl]methyl]isoindole-1,3-dione Openeye Name: 5-nitro-2-[[2-(trifluoromethyl)phenyl]methyl]isoindoline-1,3-dione CAS Name: 5-nitro-2-[[2-(trifluoromethyl)phenyl]methyl]isoindole-1,3-dione IUPAC Name: 5-nitro-2-[[2-(trifluoromethyl)phenyl]methyl]isoindole-1,3-dione Traditional Name: 5-nitro-2-[2-(trifluoromethyl)benzyl]isoindoline-1,3-quinone Formula: C16H9F3N2O4 MolecularWeight: 350.24887

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9F3N2O4/c17-16(18,19)13-4-2-1-3-9(13)8-20-14(22)11-6-5-10(21(24)25)7-12(11)15(20)23/h1-7H,8H2