3-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one iodide

Systemtic Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one iodide Openeye Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one iodide CAS Name: 3-(1-methyl-1-piperidin-1-iumyl)-1-phenyl-1-propanone iodide IUPAC Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenylpropan-1-one iodide Traditional Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one iodide Formula: C15H22INO MolecularWeight: 359.24575

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22NO.HI/c1-16(11-6-3-7-12-16)13-10-15(17)14-8-4-2-5-9-14;/h2,4-5,8-9H,3,6-7,10-13H2,1H3;1H/q+1;/p-1