2-(4-bromophenyl)-1-morpholin-4-ium-4-yl-propan-2-ol chloride

Systemtic Name: 2-(4-bromophenyl)-1-morpholin-4-ium-4-yl-propan-2-ol chloride Openeye Name: 2-(4-bromophenyl)-1-morpholin-4-ium-4-yl-propan-2-ol chloride CAS Name: 2-(4-bromophenyl)-1-(4-morpholin-4-iumyl)-2-propanol chloride IUPAC Name: 2-(4-bromophenyl)-1-morpholin-4-ium-4-ylpropan-2-ol chloride Traditional Name: 2-(4-bromophenyl)-1-morpholin-4-ium-4-yl-propan-2-ol chloride Formula: C13H19BrClNO2 MolecularWeight: 336.65246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCOCC1)(C2=CC=C(C=C2)Br)O.[Cl-]

Isomeric SMILES

CC(C[NH+]1CCOCC1)(C2=CC=C(C=C2)Br)O.[Cl-]

InChI

InChI=1S/C13H18BrNO2.ClH/c1-13(16,10-15-6-8-17-9-7-15)11-2-4-12(14)5-3-11;/h2-5,16H,6-10H2,1H3;1H