(4-bromanylthiophen-2-yl)methyl-[(2S)-2-ethylhexyl]azanium

Systemtic Name: (4-bromanylthiophen-2-yl)methyl-[(2S)-2-ethylhexyl]azanium Openeye Name: (4-bromo-2-thienyl)methyl-[(2S)-2-ethylhexyl]ammonium CAS Name: (4-bromo-2-thiophenyl)methyl-[(2S)-2-ethylhexyl]ammonium IUPAC Name: (4-bromothiophen-2-yl)methyl-[(2S)-2-ethylhexyl]azanium Traditional Name: (4-bromo-2-thienyl)methyl-[(2S)-2-ethylhexyl]ammonium Formula: C13H23BrNS+ MolecularWeight: 305.29742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]CC1=CC(=CS1)Br

Isomeric SMILES

CCCC[C@H](CC)C[NH2+]CC1=CC(=CS1)Br

InChI

InChI=1S/C13H22BrNS/c1-3-5-6-11(4-2)8-15-9-13-7-12(14)10-16-13/h7,10-11,15H,3-6,8-9H2,1-2H3/p+1/t11-/m0/s1