(3-bromophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium

Systemtic Name: (3-bromophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Openeye Name: (3-bromophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium CAS Name: (3-bromophenyl)methyl-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]ammonium IUPAC Name: (3-bromophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Traditional Name: (3-bromobenzyl)-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium Formula: C16H27BrN2+2 MolecularWeight: 327.30298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]CC2=CC(=CC=C2)Br

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+]CC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H25BrN2/c1-14-6-2-3-10-19(14)11-5-9-18-13-15-7-4-8-16(17)12-15/h4,7-8,12,14,18H,2-3,5-6,9-11,13H2,1H3/p+2/t14-/m0/s1