5-bromanyl-2-chloranyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide CAS Name: 5-bromo-2-chloro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide Traditional Name: 5-bromo-2-chloro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide Formula: C19H21BrClN2O+ MolecularWeight: 408.73984

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C=CC(=C1)Br)Cl)[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

C[C@H](CNC(=O)C1=C(C=CC(=C1)Br)Cl)[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H20BrClN2O/c1-13(23-9-8-14-4-2-3-5-15(14)12-23)11-22-19(24)17-10-16(20)6-7-18(17)21/h2-7,10,13H,8-9,11-12H2,1H3,(H,22,24)/p+1/t13-/m1/s1