3,5-dinitro-N-[(1R)-2,2,2-tris(chloranyl)-1-piperidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3,5-dinitro-N-[(1R)-2,2,2-tris(chloranyl)-1-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3,5-dinitro-N-[(1R)-2,2,2-trichloro-1-piperidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3,5-dinitro-N-[(1R)-2,2,2-trichloro-1-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 3,5-dinitro-N-[(1R)-2,2,2-trichloro-1-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 3,5-dinitro-N-[(1R)-2,2,2-trichloro-1-piperidin-1-ium-1-yl-ethyl]benzamide Formula: C14H16Cl3N4O5+ MolecularWeight: 426.65964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)[C@H](C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H15Cl3N4O5/c15-14(16,17)13(19-4-2-1-3-5-19)18-12(22)9-6-10(20(23)24)8-11(7-9)21(25)26/h6-8,13H,1-5H2,(H,18,22)/p+1/t13-/m1/s1