N-butyl-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-butyl-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-butyl-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-butyl-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-butyl-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-butyl-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C9H14N4O3 MolecularWeight: 226.23246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14N4O3/c1-3-4-5-10-9(14)8-7(13(15)16)6-12(2)11-8/h6H,3-5H2,1-2H3,(H,10,14)