1-[4-(2-bromanyl-4-methyl-phenoxy)butyl]piperidin-1-ium

Systemtic Name: 1-[4-(2-bromanyl-4-methyl-phenoxy)butyl]piperidin-1-ium Openeye Name: 1-[4-(2-bromo-4-methyl-phenoxy)butyl]piperidin-1-ium CAS Name: 1-[4-(2-bromo-4-methylphenoxy)butyl]piperidin-1-ium IUPAC Name: 1-[4-(2-bromo-4-methylphenoxy)butyl]piperidin-1-ium Traditional Name: 1-[4-(2-bromo-4-methyl-phenoxy)butyl]piperidin-1-ium Formula: C16H25BrNO+ MolecularWeight: 327.2798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC[NH+]2CCCCC2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC[NH+]2CCCCC2)Br

InChI

InChI=1S/C16H24BrNO/c1-14-7-8-16(15(17)13-14)19-12-6-5-11-18-9-3-2-4-10-18/h7-8,13H,2-6,9-12H2,1H3/p+1