(3R,6S)-1-fluoranyl-4-methoxy-3-nitro-6-(trinitromethyl)cyclohexa-1,4-diene

Systemtic Name: (3R,6S)-1-fluoranyl-4-methoxy-3-nitro-6-(trinitromethyl)cyclohexa-1,4-diene Openeye Name: (3R,6S)-1-fluoro-4-methoxy-3-nitro-6-(trinitromethyl)cyclohexa-1,4-diene CAS Name: (3R,6S)-1-fluoro-4-methoxy-3-nitro-6-(trinitromethyl)cyclohexa-1,4-diene IUPAC Name: (3R,6S)-1-fluoro-4-methoxy-3-nitro-6-(trinitromethyl)cyclohexa-1,4-diene Traditional Name: (3R,6S)-1-fluoro-4-methoxy-3-nitro-6-(trinitromethyl)cyclohexa-1,4-diene Formula: C8H7FN4O9 MolecularWeight: 322.160983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(C(=CC1[N+](=O)[O-])F)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C[C@H](C(=C[C@H]1[N+](=O)[O-])F)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H7FN4O9/c1-22-7-2-4(5(9)3-6(7)10(14)15)8(11(16)17,12(18)19)13(20)21/h2-4,6H,1H3/t4-,6-/m1/s1