[(2R)-2-(4-bromophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(4-bromophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(4-bromophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(4-bromophenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(4-bromophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(4-bromophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C14H23BrN2+2 MolecularWeight: 299.24982

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C[NH3+])C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C[NH3+])C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H21BrN2/c1-11-3-2-8-17(10-11)14(9-16)12-4-6-13(15)7-5-12/h4-7,11,14H,2-3,8-10,16H2,1H3/p+2/t11-,14-/m0/s1