4-[(6-chloranylpyridin-3-yl)methyl]piperazin-4-ium-2-one

Systemtic Name: 4-[(6-chloranylpyridin-3-yl)methyl]piperazin-4-ium-2-one Openeye Name: 4-[(6-chloro-3-pyridyl)methyl]piperazin-4-ium-2-one CAS Name: 4-[(6-chloro-3-pyridinyl)methyl]-2-piperazin-4-iumone IUPAC Name: 4-[(6-chloropyridin-3-yl)methyl]piperazin-4-ium-2-one Traditional Name: 4-[(6-chloro-3-pyridyl)methyl]piperazin-4-ium-2-one Formula: C10H13ClN3O+ MolecularWeight: 226.68272

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC2=CN=C(C=C2)Cl

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC2=CN=C(C=C2)Cl

InChI

InChI=1S/C10H12ClN3O/c11-9-2-1-8(5-13-9)6-14-4-3-12-10(15)7-14/h1-2,5H,3-4,6-7H2,(H,12,15)/p+1