4-(4-methylmorpholin-4-ium-4-yl)-1-thiophen-3-yl-butan-1-one iodide

Systemtic Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-thiophen-3-yl-butan-1-one iodide Openeye Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-(3-thienyl)butan-1-one iodide CAS Name: 4-(4-methyl-4-morpholin-4-iumyl)-1-(3-thiophenyl)-1-butanone iodide IUPAC Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-thiophen-3-ylbutan-1-one iodide Traditional Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-(3-thienyl)butan-1-one iodide Formula: C13H20INO2S MolecularWeight: 381.27287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCCC(=O)C2=CSC=C2.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CCCC(=O)C2=CSC=C2.[I-]

InChI

InChI=1S/C13H20NO2S.HI/c1-14(6-8-16-9-7-14)5-2-3-13(15)12-4-10-17-11-12;/h4,10-11H,2-3,5-9H2,1H3;1H/q+1;/p-1