[2,2-bis(fluoranyl)-2-nitro-ethyl] 4-chloranylbenzenesulfonate

Systemtic Name: [2,2-bis(fluoranyl)-2-nitro-ethyl] 4-chloranylbenzenesulfonate Openeye Name: (2,2-difluoro-2-nitro-ethyl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid (2,2-difluoro-2-nitroethyl) ester IUPAC Name: (2,2-difluoro-2-nitroethyl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (2,2-difluoro-2-nitro-ethyl) ester Formula: C8H6ClF2NO5S MolecularWeight: 301.651746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)OCC([N+](=O)[O-])(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)OCC([N+](=O)[O-])(F)F)Cl

InChI

InChI=1S/C8H6ClF2NO5S/c9-6-1-3-7(4-2-6)18(15,16)17-5-8(10,11)12(13)14/h1-4H,5H2