1-[(2R,4S,5R)-5-(hydroxymethyl)-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione iodide

Systemtic Name: 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione iodide Openeye Name: 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione iodide CAS Name: 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]-2-oxolanyl]-5-methylpyrimidine-2,4-dione iodide IUPAC Name: 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]oxolan-2-yl]-5-methylpyrimidine-2,4-dione iodide Traditional Name: 5-methyl-1-[(2R,4S,5R)-5-methylol-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]tetrahydrofuran-2-yl]pyrimidine-2,4-quinone iodide Formula: C18H30IN3O5 MolecularWeight: 495.35237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)OCC[N+]3(CCCCC3)C.[I-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)OCC[N+]3(CCCCC3)C.[I-]

InChI

InChI=1S/C18H29N3O5.HI/c1-13-11-20(18(24)19-17(13)23)16-10-14(15(12-22)26-16)25-9-8-21(2)6-4-3-5-7-21;/h11,14-16,22H,3-10,12H2,1-2H3;1H/t14-,15+,16+;/m0./s1