(3S)-1-[2-(dimethylamino)-5,6-dimethyl-pyrimidin-3-ium-4-yl]piperidin-3-ol

Systemtic Name: (3S)-1-[2-(dimethylamino)-5,6-dimethyl-pyrimidin-3-ium-4-yl]piperidin-3-ol Openeye Name: (3S)-1-[2-(dimethylamino)-5,6-dimethyl-pyrimidin-3-ium-4-yl]piperidin-3-ol CAS Name: (3S)-1-[2-(dimethylamino)-5,6-dimethyl-4-pyrimidin-3-iumyl]-3-piperidinol IUPAC Name: (3S)-1-[2-(dimethylamino)-5,6-dimethylpyrimidin-3-ium-4-yl]piperidin-3-ol Traditional Name: (3S)-1-[2-(dimethylamino)-5,6-dimethyl-pyrimidin-3-ium-4-yl]piperidin-3-ol Formula: C13H23N4O+ MolecularWeight: 251.34792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C([NH+]=C1N2CCCC(C2)O)N(C)C)C

Isomeric SMILES

CC1=C(N=C([NH+]=C1N2CCC[C@@H](C2)O)N(C)C)C

InChI

InChI=1S/C13H22N4O/c1-9-10(2)14-13(16(3)4)15-12(9)17-7-5-6-11(18)8-17/h11,18H,5-8H2,1-4H3/p+1/t11-/m0/s1