3-bromanyl-5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazole

Systemtic Name: 3-bromanyl-5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazole Openeye Name: 3-bromo-5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazole CAS Name: 3-bromo-5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazole IUPAC Name: 3-bromo-5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazole Traditional Name: 3-bromo-5-nosyl-1H-1,2,4-triazole Formula: C8H5BrN4O4S MolecularWeight: 333.1187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)C2=NC(=NN2)Br

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)C2=NC(=NN2)Br

InChI

InChI=1S/C8H5BrN4O4S/c9-7-10-8(12-11-7)18(16,17)6-3-1-5(2-4-6)13(14)15/h1-4H,(H,10,11,12)