4-chloranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide Openeye Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide CAS Name: 4-chloro-N-[2-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]benzamide IUPAC Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide Traditional Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide Formula: C17H20ClN4O+ MolecularWeight: 331.8199

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=CC=N2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=CC=N2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN4O/c1-21-9-11-22(12-10-21)16-15(3-2-8-19-16)20-17(23)13-4-6-14(18)7-5-13/h2-8H,9-12H2,1H3,(H,20,23)/p+1