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

Systemtic Name: 4-chloranyl-3-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-3-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-3-nitro-N-[3-(1-pyrazolylmethyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-3-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-3-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Formula: C14H11ClN6O3 MolecularWeight: 346.72854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN6O3/c15-11-12(18-19-13(11)21(23)24)14(22)17-10-4-1-3-9(7-10)8-20-6-2-5-16-20/h1-7H,8H2,(H,17,22)(H,18,19)