N-(furan-2-ylmethyl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(2-furylmethyl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-(2-furanylmethyl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(2-furfuryl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C21H17F3N2O7S MolecularWeight: 498.42909

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CN(CC3=CC=CO3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CN(CC3=CC=CO3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H17F3N2O7S/c22-21(23,24)16-3-1-5-19(9-16)34(29,30)25(11-18-4-2-6-32-18)10-14-7-17(26(27)28)8-15-12-31-13-33-20(14)15/h1-9H,10-13H2