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

Systemtic Name: N-[2-propoxy-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-propoxy-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-propoxy-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-propoxy-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-propoxy-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C18H18F3NO5S MolecularWeight: 417.39943

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H18F3NO5S/c1-2-7-25-15-5-3-12(18(19,20)21)10-14(15)22-28(23,24)13-4-6-16-17(11-13)27-9-8-26-16/h3-6,10-11,22H,2,7-9H2,1H3