N-[(4-bromanylthiophen-2-yl)methyl]-3-piperidin-1-ium-1-yl-propan-1-amine

Systemtic Name: N-[(4-bromanylthiophen-2-yl)methyl]-3-piperidin-1-ium-1-yl-propan-1-amine Openeye Name: N-[(4-bromo-2-thienyl)methyl]-3-piperidin-1-ium-1-yl-propan-1-amine CAS Name: N-[(4-bromo-2-thiophenyl)methyl]-3-(1-piperidin-1-iumyl)-1-propanamine IUPAC Name: N-[(4-bromothiophen-2-yl)methyl]-3-piperidin-1-ium-1-ylpropan-1-amine Traditional Name: (4-bromo-2-thienyl)methyl-(3-piperidin-1-ium-1-ylpropyl)amine Formula: C13H22BrN2S+ MolecularWeight: 318.29618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNCC2=CC(=CS2)Br

Isomeric SMILES

C1CC[NH+](CC1)CCCNCC2=CC(=CS2)Br

InChI

InChI=1S/C13H21BrN2S/c14-12-9-13(17-11-12)10-15-5-4-8-16-6-2-1-3-7-16/h9,11,15H,1-8,10H2/p+1