3-nitro-1-(2-oxidanylbutyl)pyrazole-4-carboxamide

Systemtic Name: 3-nitro-1-(2-oxidanylbutyl)pyrazole-4-carboxamide Openeye Name: 1-(2-hydroxybutyl)-3-nitro-pyrazole-4-carboxamide CAS Name: 1-(2-hydroxybutyl)-3-nitro-4-pyrazolecarboxamide IUPAC Name: 1-(2-hydroxybutyl)-3-nitropyrazole-4-carboxamide Traditional Name: 1-(2-hydroxybutyl)-3-nitro-pyrazole-4-carboxamide Formula: C8H12N4O4 MolecularWeight: 228.20528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C=C(C(=N1)[N+](=O)[O-])C(=O)N)O

Isomeric SMILES

CCC(CN1C=C(C(=N1)[N+](=O)[O-])C(=O)N)O

InChI

InChI=1S/C8H12N4O4/c1-2-5(13)3-11-4-6(7(9)14)8(10-11)12(15)16/h4-5,13H,2-3H2,1H3,(H2,9,14)