(1S,2S)-2-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)cyclohexan-1-ol iodide

Systemtic Name: (1S,2S)-2-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)cyclohexan-1-ol iodide Openeye Name: (1S,2S)-2-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)cyclohexanol iodide CAS Name: (1S,2S)-2-(1-methyl-4-phenyl-1-piperidin-1-iumyl)-1-cyclohexanol iodide IUPAC Name: (1S,2S)-2-(1-methyl-4-phenylpiperidin-1-ium-1-yl)cyclohexan-1-ol iodide Traditional Name: (1S,2S)-2-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)cyclohexanol iodide Formula: C18H28INO MolecularWeight: 401.32549

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)C2=CC=CC=C2)C3CCCCC3O.[I-]

Isomeric SMILES

C[N+]1(CCC(CC1)C2=CC=CC=C2)[C@H]3CCCC[C@@H]3O.[I-]

InChI

InChI=1S/C18H28NO.HI/c1-19(17-9-5-6-10-18(17)20)13-11-16(12-14-19)15-7-3-2-4-8-15;/h2-4,7-8,16-18,20H,5-6,9-14H2,1H3;1H/q+1;/p-1/t16?,17-,18-,19?;/m0./s1