N-[2-[3,4-bis(trifluoromethyl)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name: N-[2-[3,4-bis(trifluoromethyl)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: N-[2-[3,4-bis(trifluoromethyl)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: N-[2-[3,4-bis(trifluoromethyl)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: N-[2-[3,4-bis(trifluoromethyl)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: N-[2-[3,4-bis(trifluoromethyl)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C21H13F6NO4S MolecularWeight: 489.387639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)C4=CC(=C(C=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)C4=CC(=C(C=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H13F6NO4S/c22-20(23,24)15-8-6-12(10-16(15)21(25,26)27)19-31-17-9-7-13(11-18(17)32-19)28-33(29,30)14-4-2-1-3-5-14/h1-11,19,28H