2-bromanyl-3-(1-fluoranyl-2-methyl-2-nitro-propyl)-5,6-dimethyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-bromanyl-3-(1-fluoranyl-2-methyl-2-nitro-propyl)-5,6-dimethyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-bromo-3-(1-fluoro-2-methyl-2-nitro-propyl)-5,6-dimethyl-1,4-benzoquinone CAS Name: 2-bromo-3-(1-fluoro-2-methyl-2-nitropropyl)-5,6-dimethylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-bromo-3-(1-fluoro-2-methyl-2-nitropropyl)-5,6-dimethylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-bromo-3-(1-fluoro-2-methyl-2-nitro-propyl)-5,6-dimethyl-p-benzoquinone Formula: C12H13BrFNO4 MolecularWeight: 334.138323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C(C(C)(C)[N+](=O)[O-])F)Br)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C(C(C)(C)[N+](=O)[O-])F)Br)C

InChI

InChI=1S/C12H13BrFNO4/c1-5-6(2)10(17)8(13)7(9(5)16)11(14)12(3,4)15(18)19/h11H,1-4H3