2-[2-(4-bromanylphenoxy)ethyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[2-(4-bromanylphenoxy)ethyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[2-(4-bromophenoxy)ethyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[2-(4-bromophenoxy)ethyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[2-(4-bromophenoxy)ethyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[2-(4-bromophenoxy)ethyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C19H23BrNO3+ MolecularWeight: 393.29482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CCOC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CCOC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C19H22BrNO3/c1-22-18-11-14-7-8-21(13-15(14)12-19(18)23-2)9-10-24-17-5-3-16(20)4-6-17/h3-6,11-12H,7-10,13H2,1-2H3/p+1