[(1S,2S)-1-(4-bromophenyl)-2-methyl-pentyl]azanium

Systemtic Name: [(1S,2S)-1-(4-bromophenyl)-2-methyl-pentyl]azanium Openeye Name: [(1S,2S)-1-(4-bromophenyl)-2-methyl-pentyl]ammonium CAS Name: [(1S,2S)-1-(4-bromophenyl)-2-methylpentyl]ammonium IUPAC Name: [(1S,2S)-1-(4-bromophenyl)-2-methylpentyl]azanium Traditional Name: [(1S,2S)-1-(4-bromophenyl)-2-methyl-pentyl]ammonium Formula: C12H19BrN+ MolecularWeight: 257.18996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(C1=CC=C(C=C1)Br)[NH3+]

Isomeric SMILES

CCC[C@H](C)[C@@H](C1=CC=C(C=C1)Br)[NH3+]

InChI

InChI=1S/C12H18BrN/c1-3-4-9(2)12(14)10-5-7-11(13)8-6-10/h5-9,12H,3-4,14H2,1-2H3/p+1/t9-,12-/m0/s1