N-(2-chloranylpyridin-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C17H20ClN4O+ MolecularWeight: 331.8199

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(N=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(N=CC=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H19ClN4O/c18-17-15(7-4-8-19-17)20-16(23)13-21-9-11-22(12-10-21)14-5-2-1-3-6-14/h1-8H,9-13H2,(H,20,23)/p+1