(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 5-[(4-bromophenyl)sulfamoyl]-2-chloranyl-benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 5-[(4-bromophenyl)sulfamoyl]-2-chloranyl-benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 5-[(4-bromophenyl)sulfamoyl]-2-chloro-benzoate CAS Name: 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate Traditional Name: 5-[(4-bromophenyl)sulfamoyl]-2-chloro-benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C21H14BrClN4O5S MolecularWeight: 549.78166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C21H14BrClN4O5S/c22-13-5-7-14(8-6-13)25-33(30,31)15-9-10-18(23)17(11-15)21(29)32-12-27-20(28)16-3-1-2-4-19(16)24-26-27/h1-11,25H,12H2