1-(3-bromophenyl)-2-[(2R)-2-ethylpiperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(3-bromophenyl)-2-[(2R)-2-ethylpiperidin-1-ium-1-yl]ethanone Openeye Name: 1-(3-bromophenyl)-2-[(2R)-2-ethylpiperidin-1-ium-1-yl]ethanone CAS Name: 1-(3-bromophenyl)-2-[(2R)-2-ethyl-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(3-bromophenyl)-2-[(2R)-2-ethylpiperidin-1-ium-1-yl]ethanone Traditional Name: 1-(3-bromophenyl)-2-[(2R)-2-ethylpiperidin-1-ium-1-yl]ethanone Formula: C15H21BrNO+ MolecularWeight: 311.23734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1CC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C15H20BrNO/c1-2-14-8-3-4-9-17(14)11-15(18)12-6-5-7-13(16)10-12/h5-7,10,14H,2-4,8-9,11H2,1H3/p+1/t14-/m1/s1