N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C20H20F2N2O5S MolecularWeight: 438.445006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C20H20F2N2O5S/c21-20(22)28-17-9-6-15(13-18(17)29-20)23-19(25)10-5-14-3-7-16(8-4-14)30(26,27)24-11-1-2-12-24/h3-4,6-9,13H,1-2,5,10-12H2,(H,23,25)