N-(4,6-dimethylpyrimidin-2-yl)-3,5-dinitro-benzamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-3,5-dinitro-benzamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-3,5-dinitro-benzamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-3,5-dinitrobenzamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-3,5-dinitrobenzamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-3,5-dinitro-benzamide Formula: C13H11N5O5 MolecularWeight: 317.25694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C13H11N5O5/c1-7-3-8(2)15-13(14-7)16-12(19)9-4-10(17(20)21)6-11(5-9)18(22)23/h3-6H,1-2H3,(H,14,15,16,19)