3-nitro-N-[2-(phenylmethyl)pyrazol-3-yl]benzamide

Systemtic Name: 3-nitro-N-[2-(phenylmethyl)pyrazol-3-yl]benzamide Openeye Name: N-(2-benzylpyrazol-3-yl)-3-nitro-benzamide CAS Name: 3-nitro-N-[2-(phenylmethyl)-3-pyrazolyl]benzamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-3-nitrobenzamide Traditional Name: N-(2-benzylpyrazol-3-yl)-3-nitro-benzamide Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O3/c22-17(14-7-4-8-15(11-14)21(23)24)19-16-9-10-18-20(16)12-13-5-2-1-3-6-13/h1-11H,12H2,(H,19,22)