(5-fluoranyl-2-nitro-phenyl) 4-methylsulfonylbenzenesulfonate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 4-methylsulfonylbenzenesulfonate Openeye Name: (5-fluoro-2-nitro-phenyl) 4-methylsulfonylbenzenesulfonate CAS Name: 4-methylsulfonylbenzenesulfonic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 4-methylsulfonylbenzenesulfonate Traditional Name: 4-mesylbenzenesulfonic acid (5-fluoro-2-nitro-phenyl) ester Formula: C13H10FNO7S2 MolecularWeight: 375.349403

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C13H10FNO7S2/c1-23(18,19)10-3-5-11(6-4-10)24(20,21)22-13-8-9(14)2-7-12(13)15(16)17/h2-8H,1H3