3-nitro-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]benzamide

Systemtic Name: 3-nitro-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]benzamide Openeye Name: 3-nitro-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]benzamide CAS Name: 3-nitro-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]benzamide IUPAC Name: 3-nitro-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]benzamide Traditional Name: 3-nitro-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]benzamide Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC2=CC(=NC=C2)N3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC2=CC(=NC=C2)N3C=CC=N3

InChI

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