1-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(5-bromo-2-thienyl)methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[(5-bromothiophen-2-yl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(5-bromo-2-thienyl)methyl]piperazin-4-ium-1-yl]ethanone Formula: C11H16BrN2OS+ MolecularWeight: 304.22654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=CC=C(S2)Br

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=CC=C(S2)Br

InChI

InChI=1S/C11H15BrN2OS/c1-9(15)14-6-4-13(5-7-14)8-10-2-3-11(12)16-10/h2-3H,4-8H2,1H3/p+1