2-(4-fluorophenyl)-4-(4-methylmorpholin-4-ium-4-yl)-3-phenyl-butan-2-ol iodide

Systemtic Name: 2-(4-fluorophenyl)-4-(4-methylmorpholin-4-ium-4-yl)-3-phenyl-butan-2-ol iodide Openeye Name: 2-(4-fluorophenyl)-4-(4-methylmorpholin-4-ium-4-yl)-3-phenyl-butan-2-ol iodide CAS Name: 2-(4-fluorophenyl)-4-(4-methyl-4-morpholin-4-iumyl)-3-phenyl-2-butanol iodide IUPAC Name: 2-(4-fluorophenyl)-4-(4-methylmorpholin-4-ium-4-yl)-3-phenylbutan-2-ol iodide Traditional Name: 2-(4-fluorophenyl)-4-(4-methylmorpholin-4-ium-4-yl)-3-phenyl-butan-2-ol iodide Formula: C21H27FINO2 MolecularWeight: 471.347453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)(C(C[N+]2(CCOCC2)C)C3=CC=CC=C3)O.[I-]

Isomeric SMILES

CC(C1=CC=C(C=C1)F)(C(C[N+]2(CCOCC2)C)C3=CC=CC=C3)O.[I-]

InChI

InChI=1S/C21H27FNO2.HI/c1-21(24,18-8-10-19(22)11-9-18)20(17-6-4-3-5-7-17)16-23(2)12-14-25-15-13-23;/h3-11,20,24H,12-16H2,1-2H3;1H/q+1;/p-1