N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-(ethylamino)-5-triflyl-phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C17H17F3N2O6S2 MolecularWeight: 466.45189

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H17F3N2O6S2/c1-2-21-13-5-3-11(29(23,24)17(18,19)20)9-14(13)22-30(25,26)12-4-6-15-16(10-12)28-8-7-27-15/h3-6,9-10,21-22H,2,7-8H2,1H3