3-phenyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-yl-ethyl]propanamide

Systemtic Name: 3-phenyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-yl-ethyl]propanamide Openeye Name: 3-phenyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-(2-thienyl)ethyl]propanamide CAS Name: 3-phenyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-ylethyl]propanamide IUPAC Name: 3-phenyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-ylethyl]propanamide Traditional Name: 3-phenyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-(2-thienyl)ethyl]propionamide Formula: C24H27N2OS+ MolecularWeight: 391.54898

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)C(CNC(=O)CCC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)[C@H](CNC(=O)CCC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C24H26N2OS/c27-24(13-12-19-7-2-1-3-8-19)25-17-22(23-11-6-16-28-23)26-15-14-20-9-4-5-10-21(20)18-26/h1-11,16,22H,12-15,17-18H2,(H,25,27)/p+1/t22-/m1/s1