(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate

Systemtic Name: (6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate Openeye Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate CAS Name: 4-[(4-fluorophenyl)sulfonylamino]benzoic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate Traditional Name: 4-[(4-fluorophenyl)sulfonylamino]benzoic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C22H17F2NO6S MolecularWeight: 461.435286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C22H17F2NO6S/c23-17-3-7-20(8-4-17)32(27,28)25-19-5-1-14(2-6-19)22(26)30-12-16-10-18(24)9-15-11-29-13-31-21(15)16/h1-10,25H,11-13H2