(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 5-(dimethylsulfamoyl)-2-fluoro-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-fluorobenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 5-(dimethylsulfamoyl)-2-fluorobenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-fluoro-benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H15FN4O5S MolecularWeight: 406.388203

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H15FN4O5S/c1-21(2)28(25,26)11-7-8-14(18)13(9-11)17(24)27-10-22-16(23)12-5-3-4-6-15(12)19-20-22/h3-9H,10H2,1-2H3