N-(5-chloranylpyridin-2-yl)-2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)acetamide CAS Name: N-(5-chloro-2-pyridinyl)-2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]acetamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)acetamide Traditional Name: N-(5-chloro-2-pyridyl)-2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)acetamide Formula: C16H17ClN5O2+ MolecularWeight: 346.79148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C16H16ClN5O2/c17-12-4-5-13(19-11-12)20-15(23)16(24)22-9-7-21(8-10-22)14-3-1-2-6-18-14/h1-6,11H,7-10H2,(H,19,20,23)/p+1