N-butyl-N-(4-methyl-5-nitro-pyridin-2-yl)-5-nitro-2-oxidanyl-benzamide

Systemtic Name: N-butyl-N-(4-methyl-5-nitro-pyridin-2-yl)-5-nitro-2-oxidanyl-benzamide Openeye Name: N-butyl-2-hydroxy-N-(4-methyl-5-nitro-2-pyridyl)-5-nitro-benzamide CAS Name: N-butyl-2-hydroxy-N-(4-methyl-5-nitro-2-pyridinyl)-5-nitrobenzamide IUPAC Name: N-butyl-2-hydroxy-N-(4-methyl-5-nitropyridin-2-yl)-5-nitrobenzamide Traditional Name: N-butyl-2-hydroxy-N-(4-methyl-5-nitro-2-pyridyl)-5-nitro-benzamide Formula: C17H18N4O6 MolecularWeight: 374.34802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC=C(C(=C1)C)[N+](=O)[O-])C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCCN(C1=NC=C(C(=C1)C)[N+](=O)[O-])C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H18N4O6/c1-3-4-7-19(16-8-11(2)14(10-18-16)21(26)27)17(23)13-9-12(20(24)25)5-6-15(13)22/h5-6,8-10,22H,3-4,7H2,1-2H3