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

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-2-methyl-3,5-dinitro-benzamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-2-methyl-3,5-dinitro-benzamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-2-methyl-3,5-dinitrobenzamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-2-methyl-3,5-dinitro-benzamide Formula: C14H13N5O5 MolecularWeight: 331.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C14H13N5O5/c1-7-4-8(2)16-14(15-7)17-13(20)11-5-10(18(21)22)6-12(9(11)3)19(23)24/h4-6H,1-3H3,(H,15,16,17,20)