1-[(2R,3R)-1,3-dinitrobutan-2-yl]-2-fluoranyl-benzene

Systemtic Name: 1-[(2R,3R)-1,3-dinitrobutan-2-yl]-2-fluoranyl-benzene Openeye Name: 1-fluoro-2-[(1R,2R)-2-nitro-1-(nitromethyl)propyl]benzene CAS Name: 1-[(2R,3R)-1,3-dinitrobutan-2-yl]-2-fluorobenzene IUPAC Name: 1-[(2R,3R)-1,3-dinitrobutan-2-yl]-2-fluorobenzene Traditional Name: 1-fluoro-2-[(1R,2R)-2-nitro-1-(nitromethyl)propyl]benzene Formula: C10H11FN2O4 MolecularWeight: 242.203743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C[N+](=O)[O-])C1=CC=CC=C1F)[N+](=O)[O-]

Isomeric SMILES

C[C@H]([C@@H](C[N+](=O)[O-])C1=CC=CC=C1F)[N+](=O)[O-]

InChI

InChI=1S/C10H11FN2O4/c1-7(13(16)17)9(6-12(14)15)8-4-2-3-5-10(8)11/h2-5,7,9H,6H2,1H3/t7-,9-/m1/s1