(3-fluorophenyl) 6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonate

Systemtic Name: (3-fluorophenyl) 6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonate Openeye Name: (3-fluorophenyl) 6-chloro-3-oxo-4H-1,4-benzoxazine-7-sulfonate CAS Name: 6-chloro-3-oxo-4H-1,4-benzoxazine-7-sulfonic acid (3-fluorophenyl) ester IUPAC Name: (3-fluorophenyl) 6-chloro-3-oxo-4H-1,4-benzoxazine-7-sulfonate Traditional Name: 6-chloro-3-keto-4H-1,4-benzoxazine-7-sulfonic acid (3-fluorophenyl) ester Formula: C14H9ClFNO5S MolecularWeight: 357.741363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC(=C(C=C2O1)S(=O)(=O)OC3=CC(=CC=C3)F)Cl

Isomeric SMILES

C1C(=O)NC2=CC(=C(C=C2O1)S(=O)(=O)OC3=CC(=CC=C3)F)Cl

InChI

InChI=1S/C14H9ClFNO5S/c15-10-5-11-12(21-7-14(18)17-11)6-13(10)23(19,20)22-9-3-1-2-8(16)4-9/h1-6H,7H2,(H,17,18)