(4-ethylpiperazin-4-ium-1-yl)-pyridin-2-yl-methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-pyridin-2-yl-methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(2-pyridyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(2-pyridinyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-pyridin-2-ylmethanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(2-pyridyl)methanone Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O/c1-2-14-7-9-15(10-8-14)12(16)11-5-3-4-6-13-11/h3-6H,2,7-10H2,1H3/p+1