2-[2-(4-bromophenyl)sulfonylethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[2-(4-bromophenyl)sulfonylethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[2-(4-bromophenyl)sulfonylethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(2-brosylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H19BrNO2S+ MolecularWeight: 381.30726

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H18BrNO2S/c18-16-5-7-17(8-6-16)22(20,21)12-11-19-10-9-14-3-1-2-4-15(14)13-19/h1-8H,9-13H2/p+1