4-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 4-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 4-nitro-N-[3-(1-pyrazolylmethyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 4-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Formula: C14H12N6O3 MolecularWeight: 312.28348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=C(C=NN2)[N+](=O)[O-])CN3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=C(C=NN2)[N+](=O)[O-])CN3C=CC=N3

InChI

InChI=1S/C14H12N6O3/c21-14(13-12(20(22)23)8-15-18-13)17-11-4-1-3-10(7-11)9-19-6-2-5-16-19/h1-8H,9H2,(H,15,18)(H,17,21)