3-(4-methoxyphenyl)-8-(1-methylpyrrolidin-1-ium-1-yl)-8H-thieno[2,3-b]pyrrolizine iodide

Systemtic Name: 3-(4-methoxyphenyl)-8-(1-methylpyrrolidin-1-ium-1-yl)-8H-thieno[2,3-b]pyrrolizine iodide Openeye Name: 3-(4-methoxyphenyl)-8-(1-methylpyrrolidin-1-ium-1-yl)-8H-thieno[2,3-b]pyrrolizine iodide CAS Name: 3-(4-methoxyphenyl)-8-(1-methyl-1-pyrrolidin-1-iumyl)-8H-thieno[2,3-b]pyrrolizine iodide IUPAC Name: 3-(4-methoxyphenyl)-8-(1-methylpyrrolidin-1-ium-1-yl)-8H-thieno[2,3-b]pyrrolizine iodide Traditional Name: 3-(4-methoxyphenyl)-8-(1-methylpyrrolidin-1-ium-1-yl)-8H-thieno[2,3-b]pyrrolizine iodide Formula: C21H23IN2OS MolecularWeight: 478.38959

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)C2C3=CC=CN3C4=C2SC=C4C5=CC=C(C=C5)OC.[I-]

Isomeric SMILES

C[N+]1(CCCC1)C2C3=CC=CN3C4=C2SC=C4C5=CC=C(C=C5)OC.[I-]

InChI

InChI=1S/C21H23N2OS.HI/c1-23(12-3-4-13-23)20-18-6-5-11-22(18)19-17(14-25-21(19)20)15-7-9-16(24-2)10-8-15;/h5-11,14,20H,3-4,12-13H2,1-2H3;1H/q+1;/p-1