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

Systemtic Name: [(2S)-2-(3-bromophenyl)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]ethyl]azanium Openeye Name: [(2S)-2-(3-bromophenyl)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]ethyl]ammonium CAS Name: [(2S)-2-(3-bromophenyl)-2-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]ethyl]ammonium IUPAC Name: [(2S)-2-(3-bromophenyl)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]ethyl]azanium Traditional Name: [(2S)-2-(3-bromophenyl)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]ethyl]ammonium Formula: C15H26BrN3+2 MolecularWeight: 328.29104

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(C[NH3+])C2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)[C@H](C[NH3+])C2=CC(=CC=C2)Br

InChI

InChI=1S/C15H24BrN3/c1-18-8-6-14(7-9-18)19(2)15(11-17)12-4-3-5-13(16)10-12/h3-5,10,14-15H,6-9,11,17H2,1-2H3/p+2/t15-/m1/s1