2-(4-fluoranyl-3-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(4-fluoranyl-3-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(4-fluoro-3-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(4-fluoro-3-nitrophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(4-fluoro-3-nitrophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-(4-fluoro-3-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C14H13FN2O4 MolecularWeight: 292.262423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC2C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C14H13FN2O4/c15-11-6-5-8(7-12(11)17(20)21)16-13(18)9-3-1-2-4-10(9)14(16)19/h5-7,9-10H,1-4H2