2,2,2-tris(chloranyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2,2,2-tris(chloranyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2,2,2-trichloro-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2,2,2-trichloro-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2,2,2-trichloro-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2,2,2-trichloro-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C13H17Cl3N3O+ MolecularWeight: 337.65258

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H16Cl3N3O/c1-18-6-8-19(9-7-18)11-5-3-2-4-10(11)17-12(20)13(14,15)16/h2-5H,6-9H2,1H3,(H,17,20)/p+1