2-(4-tert-butyl-2-nitro-phenyl)-4-fluoranyl-isoindole-1,3-dione

Systemtic Name: 2-(4-tert-butyl-2-nitro-phenyl)-4-fluoranyl-isoindole-1,3-dione Openeye Name: 2-(4-tert-butyl-2-nitro-phenyl)-4-fluoro-isoindoline-1,3-dione CAS Name: 2-(4-tert-butyl-2-nitrophenyl)-4-fluoroisoindole-1,3-dione IUPAC Name: 2-(4-tert-butyl-2-nitrophenyl)-4-fluoroisoindole-1,3-dione Traditional Name: 2-(4-tert-butyl-2-nitro-phenyl)-4-fluoro-isoindoline-1,3-quinone Formula: C18H15FN2O4 MolecularWeight: 342.321103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN2O4/c1-18(2,3)10-7-8-13(14(9-10)21(24)25)20-16(22)11-5-4-6-12(19)15(11)17(20)23/h4-9H,1-3H3