(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-chloranyl-5-(methylsulfamoyl)benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-chloranyl-5-(methylsulfamoyl)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-chloro-5-(methylsulfamoyl)benzoate CAS Name: 2-chloro-5-(methylsulfamoyl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-chloro-5-(methylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(methylsulfamoyl)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C16H13ClN4O5S MolecularWeight: 408.81622

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H13ClN4O5S/c1-18-27(24,25)10-6-7-13(17)12(8-10)16(23)26-9-21-15(22)11-4-2-3-5-14(11)19-20-21/h2-8,18H,9H2,1H3