2-methyl-6-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-6-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Openeye Name: 2-methyl-6-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one CAS Name: 2-methyl-6-[1-[(1-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]-1H-pyrimidin-4-one IUPAC Name: 2-methyl-6-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Traditional Name: 2-methyl-6-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Formula: C15H22N5O+ MolecularWeight: 288.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C=C(N1)C2CC[NH+](CC2)CC3=CN(N=C3)C

Isomeric SMILES

CC1=NC(=O)C=C(N1)C2CC[NH+](CC2)CC3=CN(N=C3)C

InChI

InChI=1S/C15H21N5O/c1-11-17-14(7-15(21)18-11)13-3-5-20(6-4-13)10-12-8-16-19(2)9-12/h7-9,13H,3-6,10H2,1-2H3,(H,17,18,21)/p+1