(4-bromanylthiophen-2-yl)methyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: (4-bromanylthiophen-2-yl)methyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: (4-bromo-2-thienyl)methyl-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: (4-bromo-2-thiophenyl)methyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: (4-bromothiophen-2-yl)methyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: (4-bromo-2-thienyl)methyl-[(1S)-1,4-dimethylpentyl]ammonium Formula: C12H21BrNS+ MolecularWeight: 291.27084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20BrNS/c1-9(2)4-5-10(3)14-7-12-6-11(13)8-15-12/h6,8-10,14H,4-5,7H2,1-3H3/p+1/t10-/m0/s1