N-[5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-[5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-[5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazol-3-yl]acetamide CAS Name: N-[5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-[5-(4-nitrophenyl)sulfonyl-1H-1,2,4-triazol-3-yl]acetamide Traditional Name: N-(5-nosyl-1H-1,2,4-triazol-3-yl)acetamide Formula: C10H9N5O5S MolecularWeight: 311.27396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NNC(=N1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NNC(=N1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O5S/c1-6(16)11-9-12-10(14-13-9)21(19,20)8-4-2-7(3-5-8)15(17)18/h2-5H,1H3,(H2,11,12,13,14,16)