2-methoxy-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]benzamide

Systemtic Name: 2-methoxy-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]benzamide Openeye Name: 2-methoxy-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]benzamide CAS Name: 2-methoxy-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]benzamide IUPAC Name: 2-methoxy-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]benzamide Traditional Name: 2-methoxy-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]benzamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=CC=CC=C1OC)[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC[C@H](CNC(=O)C1=CC=CC=C1OC)[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H26N2O2/c1-3-18(23-13-12-16-8-4-5-9-17(16)15-23)14-22-21(24)19-10-6-7-11-20(19)25-2/h4-11,18H,3,12-15H2,1-2H3,(H,22,24)/p+1/t18-/m1/s1