(3R)-1-[2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethoxy]ethyl]-3-methyl-piperidin-1-ium

Systemtic Name: (3R)-1-[2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethoxy]ethyl]-3-methyl-piperidin-1-ium Openeye Name: (3R)-1-[2-[2-(2-bromo-4-chloro-phenoxy)ethoxy]ethyl]-3-methyl-piperidin-1-ium CAS Name: (3R)-1-[2-[2-(2-bromo-4-chlorophenoxy)ethoxy]ethyl]-3-methylpiperidin-1-ium IUPAC Name: (3R)-1-[2-[2-(2-bromo-4-chlorophenoxy)ethoxy]ethyl]-3-methylpiperidin-1-ium Traditional Name: (3R)-1-[2-[2-(2-bromo-4-chloro-phenoxy)ethoxy]ethyl]-3-methyl-piperidin-1-ium Formula: C16H24BrClNO2+ MolecularWeight: 377.72426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCOCCOC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCOCCOC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C16H23BrClNO2/c1-13-3-2-6-19(12-13)7-8-20-9-10-21-16-5-4-14(18)11-15(16)17/h4-5,11,13H,2-3,6-10,12H2,1H3/p+1/t13-/m1/s1