N-[(1R)-3-methyl-1-phenyl-butyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-[(1R)-3-methyl-1-phenyl-butyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-[(1R)-3-methyl-1-phenyl-butyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[(1R)-3-methyl-1-phenylbutyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-[(1R)-3-methyl-1-phenylbutyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-[(1R)-3-methyl-1-phenyl-butyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O/c1-17(2)14-21(19-9-4-3-5-10-19)23-22(25)16-24-13-12-18-8-6-7-11-20(18)15-24/h3-11,17,21H,12-16H2,1-2H3,(H,23,25)/p+1/t21-/m1/s1