(1S)-3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-yl-propan-1-ol iodide

Systemtic Name: (1S)-3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-yl-propan-1-ol iodide Openeye Name: (1S)-3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-(2-thienyl)propan-1-ol iodide CAS Name: (1S)-3-(4-methyl-4-morpholin-4-iumyl)-1-phenyl-1-thiophen-2-yl-1-propanol iodide IUPAC Name: (1S)-3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-ylpropan-1-ol iodide Traditional Name: (1S)-3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-(2-thienyl)propan-1-ol iodide Formula: C18H24INO2S MolecularWeight: 445.35813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCC(C2=CC=CC=C2)(C3=CC=CS3)O.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CC[C@](C2=CC=CC=C2)(C3=CC=CS3)O.[I-]

InChI

InChI=1S/C18H24NO2S.HI/c1-19(11-13-21-14-12-19)10-9-18(20,17-8-5-15-22-17)16-6-3-2-4-7-16;/h2-8,15,20H,9-14H2,1H3;1H/q+1;/p-1/t18-;/m0./s1