N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-fluoro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-fluoro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-fluoro-3-pyrrolidinosulfonyl-benzamide Formula: C20H21FN2O5S MolecularWeight: 420.454543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)F

InChI

InChI=1S/C20H21FN2O5S/c21-16-5-4-15(12-19(16)29(25,26)23-7-1-2-8-23)20(24)22-13-14-3-6-17-18(11-14)28-10-9-27-17/h3-6,11-12H,1-2,7-10,13H2,(H,22,24)