6-methyl-3-[[4-(2-pyrazol-1-ylethyl)piperidin-1-ium-1-yl]methyl]-1H-pyridin-2-one

Systemtic Name: 6-methyl-3-[[4-(2-pyrazol-1-ylethyl)piperidin-1-ium-1-yl]methyl]-1H-pyridin-2-one Openeye Name: 6-methyl-3-[[4-(2-pyrazol-1-ylethyl)piperidin-1-ium-1-yl]methyl]-1H-pyridin-2-one CAS Name: 6-methyl-3-[[4-[2-(1-pyrazolyl)ethyl]-1-piperidin-1-iumyl]methyl]-1H-pyridin-2-one IUPAC Name: 6-methyl-3-[[4-(2-pyrazol-1-ylethyl)piperidin-1-ium-1-yl]methyl]-1H-pyridin-2-one Traditional Name: 6-methyl-3-[[4-(2-pyrazol-1-ylethyl)piperidin-1-ium-1-yl]methyl]-2-pyridone Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1)C[NH+]2CCC(CC2)CCN3C=CC=N3

Isomeric SMILES

CC1=CC=C(C(=O)N1)C[NH+]2CCC(CC2)CCN3C=CC=N3

InChI

InChI=1S/C17H24N4O/c1-14-3-4-16(17(22)19-14)13-20-10-5-15(6-11-20)7-12-21-9-2-8-18-21/h2-4,8-9,15H,5-7,10-13H2,1H3,(H,19,22)/p+1