N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H24N2O7S2 MolecularWeight: 468.54376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H24N2O7S2/c1-2-27-18-7-5-15(13-20(18)31(25,26)22-9-3-4-10-22)21-30(23,24)16-6-8-17-19(14-16)29-12-11-28-17/h5-8,13-14,21H,2-4,9-12H2,1H3