(R)-(4-bromophenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methanamine

Systemtic Name: (R)-(4-bromophenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methanamine Openeye Name: (R)-(4-bromophenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methanamine CAS Name: (R)-(4-bromophenyl)-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]methanamine IUPAC Name: (R)-(4-bromophenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methanamine Traditional Name: [(R)-(4-bromophenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]amine Formula: C14H22BrN2+ MolecularWeight: 298.24188

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C(C2=CC=C(C=C2)Br)N)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)[C@H](C2=CC=C(C=C2)Br)N)C

InChI

InChI=1S/C14H21BrN2/c1-10-7-11(2)9-17(8-10)14(16)12-3-5-13(15)6-4-12/h3-6,10-11,14H,7-9,16H2,1-2H3/p+1/t10-,11-,14+/m0/s1