N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzamide

Systemtic Name: N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzamide Openeye Name: N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzamide CAS Name: N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzamide IUPAC Name: N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzamide Traditional Name: N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzamide Formula: C17H19N2O+ MolecularWeight: 267.34556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C2=CC=CC=C21)CNC(=O)C3=CC=CC=C3

Isomeric SMILES

C1C[NH2+][C@@H](C2=CC=CC=C21)CNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O/c20-17(14-7-2-1-3-8-14)19-12-16-15-9-5-4-6-13(15)10-11-18-16/h1-9,16,18H,10-12H2,(H,19,20)/p+1/t16-/m1/s1