(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-bromanyl-5-(propan-2-ylsulfamoyl)benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-bromanyl-5-(propan-2-ylsulfamoyl)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-bromo-5-(isopropylsulfamoyl)benzoate CAS Name: 2-bromo-5-(propan-2-ylsulfamoyl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-bromo-5-(propan-2-ylsulfamoyl)benzoate Traditional Name: 2-bromo-5-(isopropylsulfamoyl)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C18H17BrN4O5S MolecularWeight: 481.32038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H17BrN4O5S/c1-11(2)21-29(26,27)12-7-8-15(19)14(9-12)18(25)28-10-23-17(24)13-5-3-4-6-16(13)20-22-23/h3-9,11,21H,10H2,1-2H3