4-bromanyl-1-fluoranyl-2-methyl-5-methylsulfonyl-3-nitro-benzene

Systemtic Name: 4-bromanyl-1-fluoranyl-2-methyl-5-methylsulfonyl-3-nitro-benzene Openeye Name: 4-bromo-1-fluoro-2-methyl-5-methylsulfonyl-3-nitro-benzene CAS Name: 4-bromo-1-fluoro-2-methyl-5-methylsulfonyl-3-nitrobenzene IUPAC Name: 4-bromo-1-fluoro-2-methyl-5-methylsulfonyl-3-nitrobenzene Traditional Name: 4-bromo-1-fluoro-5-mesyl-2-methyl-3-nitro-benzene Formula: C8H7BrFNO4S MolecularWeight: 312.112883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1F)S(=O)(=O)C)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1F)S(=O)(=O)C)Br)[N+](=O)[O-]

InChI

InChI=1S/C8H7BrFNO4S/c1-4-5(10)3-6(16(2,14)15)7(9)8(4)11(12)13/h3H,1-2H3