(4-benzamidophenyl) 3-(azetidin-1-ylsulfonyl)-4-fluoranyl-benzoate

Systemtic Name: (4-benzamidophenyl) 3-(azetidin-1-ylsulfonyl)-4-fluoranyl-benzoate Openeye Name: (4-benzamidophenyl) 3-(azetidin-1-ylsulfonyl)-4-fluoro-benzoate CAS Name: 3-(1-azetidinylsulfonyl)-4-fluorobenzoic acid (4-benzamidophenyl) ester IUPAC Name: (4-benzamidophenyl) 3-(azetidin-1-ylsulfonyl)-4-fluorobenzoate Traditional Name: 3-(azetidin-1-ylsulfonyl)-4-fluoro-benzoic acid (4-benzamidophenyl) ester Formula: C23H19FN2O5S MolecularWeight: 454.470763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4)F

Isomeric SMILES

C1CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C23H19FN2O5S/c24-20-12-7-17(15-21(20)32(29,30)26-13-4-14-26)23(28)31-19-10-8-18(9-11-19)25-22(27)16-5-2-1-3-6-16/h1-3,5-12,15H,4,13-14H2,(H,25,27)