(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl) tris(fluoranyl)methanesulfonate Openeye Name: (6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl) ester IUPAC Name: (6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl) ester Formula: C14H8F3NO5S MolecularWeight: 359.27723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C3=C(O2)C=CC(=C3)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C3=C(O2)C=CC(=C3)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H8F3NO5S/c15-14(16,17)24(20,21)23-8-5-6-11-9(7-8)13(19)18-10-3-1-2-4-12(10)22-11/h1-7H,(H,18,19)