4-bromanyl-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-bromanyl-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[[4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate Formula: C18H13BrN5O6S- MolecularWeight: 507.29472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br

Isomeric SMILES

COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C18H14BrN5O6S/c1-30-17-7-6-16(21-22-17)23-31(28,29)14-4-2-13(3-5-14)20-10-11-8-12(19)9-15(18(11)25)24(26)27/h2-10,25H,1H3,(H,21,23)/p-1