5-bromanyl-2-oxidanyl-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzamide

Systemtic Name: 5-bromanyl-2-oxidanyl-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzamide Openeye Name: 5-bromo-2-hydroxy-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzamide CAS Name: 5-bromo-2-hydroxy-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzamide IUPAC Name: 5-bromo-2-hydroxy-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzamide Traditional Name: 5-bromo-2-hydroxy-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzamide Formula: C18H20BrN2O2+ MolecularWeight: 376.2676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O2/c19-15-5-6-17(22)16(11-15)18(23)20-8-10-21-9-7-13-3-1-2-4-14(13)12-21/h1-6,11,22H,7-10,12H2,(H,20,23)/p+1