4-bromanyl-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide

Systemtic Name: 4-bromanyl-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide Openeye Name: 4-bromo-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide CAS Name: 4-bromo-N-[4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: 4-bromo-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitrobenzamide Traditional Name: 4-bromo-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-benzamide Formula: C18H13BrN6O8S MolecularWeight: 553.30022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN6O8S/c1-33-16-7-6-15(21-22-16)23-34(31,32)12-4-2-11(3-5-12)20-18(26)10-8-13(24(27)28)17(19)14(9-10)25(29)30/h2-9H,1H3,(H,20,26)(H,21,23)