N-(3-methylsulfanylphenyl)-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-(3-methylsulfanylphenyl)-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[3-(methylthio)phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[3-(methylthio)phenyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C13H19N2O2S+ MolecularWeight: 267.36716

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C[NH+]2CCOCC2

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C[NH+]2CCOCC2

InChI

InChI=1S/C13H18N2O2S/c1-18-12-4-2-3-11(9-12)14-13(16)10-15-5-7-17-8-6-15/h2-4,9H,5-8,10H2,1H3,(H,14,16)/p+1