N-(2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propanamide

Systemtic Name: N-(2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propanamide Openeye Name: N-(2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propanamide CAS Name: N-(2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propanamide IUPAC Name: N-(2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propanamide Traditional Name: N-(2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propionamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC2=C(C1)C=C(C=C2)NC(=O)CCC3=CC=CC=C3OC

Isomeric SMILES

CC[NH+]1CCC2=C(C1)C=C(C=C2)NC(=O)CCC3=CC=CC=C3OC

InChI

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