2-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzenesulfonamide

Systemtic Name: 2-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzenesulfonamide Openeye Name: 2-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzenesulfonamide CAS Name: 2-nitro-N-(1,3,5-trimethyl-4-pyrazolyl)benzenesulfonamide IUPAC Name: 2-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzenesulfonamide Traditional Name: 2-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzenesulfonamide Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O4S/c1-8-12(9(2)15(3)13-8)14-21(19,20)11-7-5-4-6-10(11)16(17)18/h4-7,14H,1-3H3