(4-nitrophenyl) 3-chloranyl-2-fluoranyl-benzenesulfonate

Systemtic Name: (4-nitrophenyl) 3-chloranyl-2-fluoranyl-benzenesulfonate Openeye Name: (4-nitrophenyl) 3-chloro-2-fluoro-benzenesulfonate CAS Name: 3-chloro-2-fluorobenzenesulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-chloro-2-fluorobenzenesulfonate Traditional Name: 3-chloro-2-fluoro-benzenesulfonic acid (4-nitrophenyl) ester Formula: C12H7ClFNO5S MolecularWeight: 331.704083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7ClFNO5S/c13-10-2-1-3-11(12(10)14)21(18,19)20-9-6-4-8(5-7-9)15(16)17/h1-7H