2-(4-methylpiperidin-1-ium-1-yl)-1-thiophen-2-yl-ethanone

Systemtic Name: 2-(4-methylpiperidin-1-ium-1-yl)-1-thiophen-2-yl-ethanone Openeye Name: 2-(4-methylpiperidin-1-ium-1-yl)-1-(2-thienyl)ethanone CAS Name: 2-(4-methyl-1-piperidin-1-iumyl)-1-thiophen-2-ylethanone IUPAC Name: 2-(4-methylpiperidin-1-ium-1-yl)-1-thiophen-2-ylethanone Traditional Name: 2-(4-methylpiperidin-1-ium-1-yl)-1-(2-thienyl)ethanone Formula: C12H18NOS+ MolecularWeight: 224.34242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)C2=CC=CS2

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)C2=CC=CS2

InChI

InChI=1S/C12H17NOS/c1-10-4-6-13(7-5-10)9-11(14)12-3-2-8-15-12/h2-3,8,10H,4-7,9H2,1H3/p+1