N-(2-chloranylpyridin-4-yl)-2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-(2-chloranylpyridin-4-yl)-2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethanamide Openeye Name: N-(2-chloro-4-pyridyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-acetamide CAS Name: N-(2-chloro-4-pyridinyl)-2-(4-methyl-1-piperazin-4-iumyl)-2-oxoacetamide IUPAC Name: N-(2-chloropyridin-4-yl)-2-(4-methylpiperazin-4-ium-1-yl)-2-oxoacetamide Traditional Name: N-(2-chloro-4-pyridyl)-2-keto-2-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C12H16ClN4O2+ MolecularWeight: 283.73404

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C(=O)NC2=CC(=NC=C2)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C(=O)NC2=CC(=NC=C2)Cl

InChI

InChI=1S/C12H15ClN4O2/c1-16-4-6-17(7-5-16)12(19)11(18)15-9-2-3-14-10(13)8-9/h2-3,8H,4-7H2,1H3,(H,14,15,18)/p+1