(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C16H12BrClN4O5S MolecularWeight: 487.71228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CNS(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CNS(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C16H12BrClN4O5S/c17-10-5-6-14(12(18)7-10)28(25,26)19-8-15(23)27-9-22-16(24)11-3-1-2-4-13(11)20-21-22/h1-7,19H,8-9H2