2-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[3-(2-bromo-4-chloro-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[3-(2-bromo-4-chlorophenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[3-(2-bromo-4-chlorophenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[3-(2-bromo-4-chloro-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C18H20BrClNO+ MolecularWeight: 381.7145

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CCCOC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CCCOC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C18H19BrClNO/c19-17-12-16(20)6-7-18(17)22-11-3-9-21-10-8-14-4-1-2-5-15(14)13-21/h1-2,4-7,12H,3,8-11,13H2/p+1