N-(3,4-dimethoxyphenyl)-3-fluoranyl-5-nitro-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-3-fluoranyl-5-nitro-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-(3,4-dimethoxyphenyl)-3-fluoro-5-nitro-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-(3,4-dimethoxyphenyl)-3-fluoro-5-nitro-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-(3,4-dimethoxyphenyl)-3-fluoro-5-nitro-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-(3,4-dimethoxyphenyl)-3-fluoro-5-nitro-4-(trifluoromethoxy)benzenesulfonamide Formula: C15H12F4N2O7S MolecularWeight: 440.323593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])OC(F)(F)F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])OC(F)(F)F)F)OC

InChI

InChI=1S/C15H12F4N2O7S/c1-26-12-4-3-8(5-13(12)27-2)20-29(24,25)9-6-10(16)14(28-15(17,18)19)11(7-9)21(22)23/h3-7,20H,1-2H3