[(3S)-1-(2,6-dimethylpyrimidin-3-ium-4-yl)piperidin-3-yl]methanol

Systemtic Name: [(3S)-1-(2,6-dimethylpyrimidin-3-ium-4-yl)piperidin-3-yl]methanol Openeye Name: [(3S)-1-(2,6-dimethylpyrimidin-3-ium-4-yl)-3-piperidyl]methanol CAS Name: [(3S)-1-(2,6-dimethyl-4-pyrimidin-3-iumyl)-3-piperidinyl]methanol IUPAC Name: [(3S)-1-(2,6-dimethylpyrimidin-3-ium-4-yl)piperidin-3-yl]methanol Traditional Name: [(3S)-1-(2,6-dimethylpyrimidin-3-ium-4-yl)-3-piperidyl]methanol Formula: C12H20N3O+ MolecularWeight: 222.3067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C)N2CCCC(C2)CO

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C)N2CCC[C@@H](C2)CO

InChI

InChI=1S/C12H19N3O/c1-9-6-12(14-10(2)13-9)15-5-3-4-11(7-15)8-16/h6,11,16H,3-5,7-8H2,1-2H3/p+1/t11-/m0/s1