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

Systemtic Name: (4-bromanylthiophen-2-yl)methyl-[(2S)-butan-2-yl]azanium Openeye Name: (4-bromo-2-thienyl)methyl-[(1S)-1-methylpropyl]ammonium CAS Name: (4-bromo-2-thiophenyl)methyl-[(2S)-butan-2-yl]ammonium IUPAC Name: (4-bromothiophen-2-yl)methyl-[(2S)-butan-2-yl]azanium Traditional Name: (4-bromo-2-thienyl)methyl-[(1S)-1-methylpropyl]ammonium Formula: C9H15BrNS+ MolecularWeight: 249.1911

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14BrNS/c1-3-7(2)11-5-9-4-8(10)6-12-9/h4,6-7,11H,3,5H2,1-2H3/p+1/t7-/m0/s1