2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ium-4-yl-propan-1-one

Systemtic Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ium-4-yl-propan-1-one Openeye Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ium-4-yl-propan-1-one CAS Name: 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholin-4-iumyl)-1-propanone IUPAC Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ium-4-ylpropan-1-one Traditional Name: 2-methyl-1-[4-(methylthio)phenyl]-2-morpholin-4-ium-4-yl-propan-1-one Formula: C15H22NO2S+ MolecularWeight: 280.40568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)SC)[NH+]2CCOCC2

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)SC)[NH+]2CCOCC2

InChI

InChI=1S/C15H21NO2S/c1-15(2,16-8-10-18-11-9-16)14(17)12-4-6-13(19-3)7-5-12/h4-7H,8-11H2,1-3H3/p+1