2-[3-[[(2R)-2-(3-methoxyphenyl)piperidin-1-ium-1-yl]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[3-[[(2R)-2-(3-methoxyphenyl)piperidin-1-ium-1-yl]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[3-[[(2R)-2-(3-methoxyphenyl)piperidin-1-ium-1-yl]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[3-[[(2R)-2-(3-methoxyphenyl)-1-piperidin-1-iumyl]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-[[(2R)-2-(3-methoxyphenyl)piperidin-1-ium-1-yl]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[3-[[(2R)-2-(3-methoxyphenyl)piperidin-1-ium-1-yl]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one Formula: C24H28N3O2+ MolecularWeight: 390.49802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)C[NH+]3CCCCC3C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)C[NH+]3CCCC[C@@H]3C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H27N3O2/c1-17-13-23(28)26-24(25-17)20-9-5-7-18(14-20)16-27-12-4-3-11-22(27)19-8-6-10-21(15-19)29-2/h5-10,13-15,22H,3-4,11-12,16H2,1-2H3,(H,25,26,28)/p+1/t22-/m1/s1