N-(2-chloranylpyridin-3-yl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(2-chloro-3-pyridyl)acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(2-chloropyridin-3-yl)acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(2-chloro-3-pyridyl)acetamide Formula: C18H22ClN4O+ MolecularWeight: 345.84648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(N=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(N=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H21ClN4O/c19-18-16(7-4-8-20-18)21-17(24)14-23-11-9-22(10-12-23)13-15-5-2-1-3-6-15/h1-8H,9-14H2,(H,21,24)/p+1