N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-nitro-benzamide

Systemtic Name: N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-nitro-benzamide Openeye Name: 2-nitro-N-[5-(p-tolyl)-1H-pyrazol-3-yl]benzamide CAS Name: N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-nitrobenzamide IUPAC Name: N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-nitrobenzamide Traditional Name: 2-nitro-N-[5-(p-tolyl)-1H-pyrazol-3-yl]benzamide Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O3/c1-11-6-8-12(9-7-11)14-10-16(20-19-14)18-17(22)13-4-2-3-5-15(13)21(23)24/h2-10H,1H3,(H2,18,19,20,22)