5-ethyl-4-nitro-1-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-ethyl-4-nitro-1-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 1-benzyl-5-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: 5-ethyl-4-nitro-1-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: 1-benzyl-5-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CC2=CC=CC=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=NN1CC2=CC=CC=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3/c1-2-10-12(17(19)20)11(13(14)18)15-16(10)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,14,18)