(5-bromanylthiophen-2-yl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (5-bromo-2-thienyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: (5-bromo-2-thienyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C12H21BrN2S+2 MolecularWeight: 305.27754

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=C(S2)Br

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=C(S2)Br

InChI

InChI=1S/C12H19BrN2S/c1-14-7-5-10(6-8-14)15(2)9-11-3-4-12(13)16-11/h3-4,10H,5-9H2,1-2H3/p+2