N-(5-ethylsulfonyl-2-oxidanyl-phenyl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(5-ethylsulfonyl-2-oxidanyl-phenyl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(5-ethylsulfonyl-2-hydroxy-phenyl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(5-ethylsulfonyl-2-hydroxyphenyl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(5-ethylsulfonyl-2-hydroxyphenyl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(5-esyl-2-hydroxy-phenyl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H12N4O6S MolecularWeight: 340.31188

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O6S/c1-2-23(21,22)7-3-4-10(17)8(5-7)13-12(18)9-6-11(15-14-9)16(19)20/h3-6,17H,2H2,1H3,(H,13,18)(H,14,15)