N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[3-methyl-4-(1-pyrrolidinyl)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(3-methyl-4-pyrrolidin-1-ylphenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(3-methyl-4-pyrrolidino-phenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C22H28N3O+ MolecularWeight: 350.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)N4CCCC4

InChI

InChI=1S/C22H27N3O/c1-17-14-20(8-9-21(17)25-11-4-5-12-25)23-22(26)16-24-13-10-18-6-2-3-7-19(18)15-24/h2-3,6-9,14H,4-5,10-13,15-16H2,1H3,(H,23,26)/p+1