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

Systemtic Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-thiophen-3-yl-butan-1-one Openeye Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-(3-thienyl)butan-1-one CAS Name: 4-(4-methyl-4-morpholin-4-iumyl)-1-(3-thiophenyl)-1-butanone IUPAC Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-thiophen-3-ylbutan-1-one Traditional Name: 4-(4-methylmorpholin-4-ium-4-yl)-1-(3-thienyl)butan-1-one Formula: C13H20NO2S+ MolecularWeight: 254.3684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20NO2S/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/q+1