2-(phenylmethyl)-5,6,7,8-tetrahydroisoquinolin-2-ium bromide

Systemtic Name: 2-(phenylmethyl)-5,6,7,8-tetrahydroisoquinolin-2-ium bromide Openeye Name: 2-benzyl-5,6,7,8-tetrahydroisoquinolin-2-ium bromide CAS Name: 2-(phenylmethyl)-5,6,7,8-tetrahydroisoquinolin-2-ium bromide IUPAC Name: 2-benzyl-5,6,7,8-tetrahydroisoquinolin-2-ium bromide Traditional Name: 2-benzyl-5,6,7,8-tetrahydroisoquinolin-2-ium bromide Formula: C16H18BrN MolecularWeight: 304.22482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C[N+](=C2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1CCC2=C(C1)C=C[N+](=C2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C16H18N.BrH/c1-2-6-14(7-3-1)12-17-11-10-15-8-4-5-9-16(15)13-17;/h1-3,6-7,10-11,13H,4-5,8-9,12H2;1H/q+1;/p-1