N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C19H17F2N3O8S MolecularWeight: 485.415386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H17F2N3O8S/c20-19(21)31-16-5-3-12(9-17(16)32-19)22-18(25)11-30-15-6-4-13(10-14(15)24(26)27)33(28,29)23-7-1-2-8-23/h3-6,9-10H,1-2,7-8,11H2,(H,22,25)