4-(1-methylpiperidin-1-ium-1-yl)phenol bromide

Systemtic Name: 4-(1-methylpiperidin-1-ium-1-yl)phenol bromide Openeye Name: 4-(1-methylpiperidin-1-ium-1-yl)phenol bromide CAS Name: 4-(1-methyl-1-piperidin-1-iumyl)phenol bromide IUPAC Name: 4-(1-methylpiperidin-1-ium-1-yl)phenol bromide Traditional Name: 4-(1-methylpiperidin-1-ium-1-yl)phenol bromide Formula: C12H18BrNO MolecularWeight: 272.18142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)C2=CC=C(C=C2)O.[Br-]

Isomeric SMILES

C[N+]1(CCCCC1)C2=CC=C(C=C2)O.[Br-]

InChI

InChI=1S/C12H17NO.BrH/c1-13(9-3-2-4-10-13)11-5-7-12(14)8-6-11;/h5-8H,2-4,9-10H2,1H3;1H