(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: (6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 2-(2-thienylsulfonylamino)benzoate CAS Name: 2-(thiophen-2-ylsulfonylamino)benzoic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-(2-thienylsulfonylamino)benzoic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H16FNO6S2 MolecularWeight: 449.472543

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CS4)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CS4)F

InChI

InChI=1S/C20H16FNO6S2/c21-15-8-13-10-26-12-28-19(13)14(9-15)11-27-20(23)16-4-1-2-5-17(16)22-30(24,25)18-6-3-7-29-18/h1-9,22H,10-12H2