(4-ethylpiperazin-4-ium-1-yl)-(6-methylpyridin-3-yl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(6-methylpyridin-3-yl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(6-methyl-3-pyridyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(6-methyl-3-pyridinyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(6-methylpyridin-3-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(6-methyl-3-pyridyl)methanone Formula: C13H20N3O+ MolecularWeight: 234.3174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O/c1-3-15-6-8-16(9-7-15)13(17)12-5-4-11(2)14-10-12/h4-5,10H,3,6-9H2,1-2H3/p+1