N-(3-morpholin-4-ium-4-yl-2,2-dinitro-propyl)benzamide

Systemtic Name: N-(3-morpholin-4-ium-4-yl-2,2-dinitro-propyl)benzamide Openeye Name: N-(3-morpholin-4-ium-4-yl-2,2-dinitro-propyl)benzamide CAS Name: N-[3-(4-morpholin-4-iumyl)-2,2-dinitropropyl]benzamide IUPAC Name: N-(3-morpholin-4-ium-4-yl-2,2-dinitropropyl)benzamide Traditional Name: N-(3-morpholin-4-ium-4-yl-2,2-dinitro-propyl)benzamide Formula: C14H19N4O6+ MolecularWeight: 339.32386

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(CNC(=O)C2=CC=CC=C2)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC(CNC(=O)C2=CC=CC=C2)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O6/c19-13(12-4-2-1-3-5-12)15-10-14(17(20)21,18(22)23)11-16-6-8-24-9-7-16/h1-5H,6-11H2,(H,15,19)/p+1