(5-fluoranyl-2-nitro-phenyl) 2,3,5,6-tetramethylbenzenesulfonate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 2,3,5,6-tetramethylbenzenesulfonate Openeye Name: (5-fluoro-2-nitro-phenyl) 2,3,5,6-tetramethylbenzenesulfonate CAS Name: 2,3,5,6-tetramethylbenzenesulfonic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 2,3,5,6-tetramethylbenzenesulfonate Traditional Name: 2,3,5,6-tetramethylbenzenesulfonic acid (5-fluoro-2-nitro-phenyl) ester Formula: C16H16FNO5S MolecularWeight: 353.365343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-])C)C

InChI

InChI=1S/C16H16FNO5S/c1-9-7-10(2)12(4)16(11(9)3)24(21,22)23-15-8-13(17)5-6-14(15)18(19)20/h5-8H,1-4H3