(1S)-1-cyclopentyl-3-[(3R)-1,1-dimethylpyrrolidin-1-ium-3-yl]-1-oxidanyl-1-thiophen-3-yl-propan-2-one iodide

Systemtic Name: (1S)-1-cyclopentyl-3-[(3R)-1,1-dimethylpyrrolidin-1-ium-3-yl]-1-oxidanyl-1-thiophen-3-yl-propan-2-one iodide Openeye Name: (1S)-1-cyclopentyl-3-[(3R)-1,1-dimethylpyrrolidin-1-ium-3-yl]-1-hydroxy-1-(3-thienyl)propan-2-one iodide CAS Name: (1S)-1-cyclopentyl-3-[(3R)-1,1-dimethyl-3-pyrrolidin-1-iumyl]-1-hydroxy-1-(3-thiophenyl)-2-propanone iodide IUPAC Name: (1S)-1-cyclopentyl-3-[(3R)-1,1-dimethylpyrrolidin-1-ium-3-yl]-1-hydroxy-1-thiophen-3-ylpropan-2-one iodide Traditional Name: (1S)-1-cyclopentyl-3-[(3R)-1,1-dimethylpyrrolidin-1-ium-3-yl]-1-hydroxy-1-(3-thienyl)acetone iodide Formula: C18H28INO2S MolecularWeight: 449.38989

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C1)CC(=O)C(C2CCCC2)(C3=CSC=C3)O)C.[I-]

Isomeric SMILES

C[N+]1(CC[C@@H](C1)CC(=O)[C@](C2CCCC2)(C3=CSC=C3)O)C.[I-]

InChI

InChI=1S/C18H28NO2S.HI/c1-19(2)9-7-14(12-19)11-17(20)18(21,15-5-3-4-6-15)16-8-10-22-13-16;/h8,10,13-15,21H,3-7,9,11-12H2,1-2H3;1H/q+1;/p-1/t14-,18+;/m1./s1