(2-chloranyl-4-nitro-phenyl) 3-fluoranylbenzenesulfonate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-fluoranylbenzenesulfonate Openeye Name: (2-chloro-4-nitro-phenyl) 3-fluorobenzenesulfonate CAS Name: 3-fluorobenzenesulfonic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-fluorobenzenesulfonate Traditional Name: 3-fluorobenzenesulfonic acid (2-chloro-4-nitro-phenyl) ester Formula: C12H7ClFNO5S MolecularWeight: 331.704083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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