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

Systemtic Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H29N3O6S2 MolecularWeight: 483.60146

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H29N3O6S2/c1-4-11-22-18-9-7-17(32(27,28)24(5-2)6-3)14-19(18)23-31(25,26)16-8-10-20-21(15-16)30-13-12-29-20/h7-10,14-15,22-23H,4-6,11-13H2,1-3H3