N-(3-morpholin-4-ium-4-ylpropyl)-3,5-dinitro-benzamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-3,5-dinitro-benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3,5-dinitro-benzamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-3,5-dinitrobenzamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-3,5-dinitrobenzamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-3,5-dinitro-benzamide Formula: C14H19N4O6+ MolecularWeight: 339.32386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O6/c19-14(15-2-1-3-16-4-6-24-7-5-16)11-8-12(17(20)21)10-13(9-11)18(22)23/h8-10H,1-7H2,(H,15,19)/p+1