(4-nitro-2-thiophen-2-yl-phenyl) 4-[bis(fluoranyl)methylsulfonyl]benzenesulfonate

Systemtic Name: (4-nitro-2-thiophen-2-yl-phenyl) 4-[bis(fluoranyl)methylsulfonyl]benzenesulfonate Openeye Name: [4-nitro-2-(2-thienyl)phenyl] 4-(difluoromethylsulfonyl)benzenesulfonate CAS Name: 4-(difluoromethylsulfonyl)benzenesulfonic acid (4-nitro-2-thiophen-2-ylphenyl) ester IUPAC Name: (4-nitro-2-thiophen-2-ylphenyl) 4-(difluoromethylsulfonyl)benzenesulfonate Traditional Name: 4-(difluoromethylsulfonyl)benzenesulfonic acid [4-nitro-2-(2-thienyl)phenyl] ester Formula: C17H11F2NO7S3 MolecularWeight: 475.463546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F

Isomeric SMILES

C1=CSC(=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F

InChI

InChI=1S/C17H11F2NO7S3/c18-17(19)29(23,24)12-4-6-13(7-5-12)30(25,26)27-15-8-3-11(20(21)22)10-14(15)16-2-1-9-28-16/h1-10,17H