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

Systemtic Name: 3-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-nitro-N-[4-(4-pyridylmethyl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-nitro-N-[4-(4-pyridylmethyl)phenyl]-1H-pyrazole-5-carboxamide Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=NC=C2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=NC=C2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O3/c22-16(14-10-15(20-19-14)21(23)24)18-13-3-1-11(2-4-13)9-12-5-7-17-8-6-12/h1-8,10H,9H2,(H,18,22)(H,19,20)