1-ethyl-N-hexyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-N-hexyl-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-ethyl-N-hexyl-4-nitro-pyrazole-3-carboxamide CAS Name: 1-ethyl-N-hexyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-hexyl-4-nitropyrazole-3-carboxamide Traditional Name: 1-ethyl-N-hexyl-4-nitro-pyrazole-3-carboxamide Formula: C12H20N4O3 MolecularWeight: 268.3122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=NN(C=C1[N+](=O)[O-])CC

Isomeric SMILES

CCCCCCNC(=O)C1=NN(C=C1[N+](=O)[O-])CC

InChI

InChI=1S/C12H20N4O3/c1-3-5-6-7-8-13-12(17)11-10(16(18)19)9-15(4-2)14-11/h9H,3-8H2,1-2H3,(H,13,17)