(2-chloranylpyridin-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (2-chloranylpyridin-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (2-chloro-3-pyridyl)-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: (2-chloro-3-pyridinyl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2-chloropyridin-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (2-chloro-3-pyridyl)-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C12H17ClN3O+ MolecularWeight: 254.73588

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(N=CC=C2)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C12H16ClN3O/c1-2-15-6-8-16(9-7-15)12(17)10-4-3-5-14-11(10)13/h3-5H,2,6-9H2,1H3/p+1