1-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-pentan-3-one iodide

Systemtic Name: 1-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-pentan-3-one iodide Openeye Name: 1-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-pentan-3-one iodide CAS Name: 1-(1-methyl-1-piperidin-1-iumyl)-5-phenyl-3-pentanone iodide IUPAC Name: 1-(1-methylpiperidin-1-ium-1-yl)-5-phenylpentan-3-one iodide Traditional Name: 1-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-pentan-3-one iodide Formula: C17H26INO MolecularWeight: 387.29891

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCC(=O)CCC2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)CCC(=O)CCC2=CC=CC=C2.[I-]

InChI

InChI=1S/C17H26NO.HI/c1-18(13-6-3-7-14-18)15-12-17(19)11-10-16-8-4-2-5-9-16;/h2,4-5,8-9H,3,6-7,10-15H2,1H3;1H/q+1;/p-1