(3R)-1-[4-(3-bromanylphenoxy)butyl]-3-methyl-piperidin-1-ium

Systemtic Name: (3R)-1-[4-(3-bromanylphenoxy)butyl]-3-methyl-piperidin-1-ium Openeye Name: (3R)-1-[4-(3-bromophenoxy)butyl]-3-methyl-piperidin-1-ium CAS Name: (3R)-1-[4-(3-bromophenoxy)butyl]-3-methylpiperidin-1-ium IUPAC Name: (3R)-1-[4-(3-bromophenoxy)butyl]-3-methylpiperidin-1-ium Traditional Name: (3R)-1-[4-(3-bromophenoxy)butyl]-3-methyl-piperidin-1-ium Formula: C16H25BrNO+ MolecularWeight: 327.2798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCCOC2=CC(=CC=C2)Br

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H24BrNO/c1-14-6-5-10-18(13-14)9-2-3-11-19-16-8-4-7-15(17)12-16/h4,7-8,12,14H,2-3,5-6,9-11,13H2,1H3/p+1/t14-/m1/s1