N-[5-ethyl-3-(2-methoxyphenyl)carbonyl-thiophen-2-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-[5-ethyl-3-(2-methoxyphenyl)carbonyl-thiophen-2-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-[5-ethyl-3-(2-methoxybenzoyl)-2-thienyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[5-ethyl-3-[(2-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-[5-ethyl-3-(2-methoxybenzoyl)thiophen-2-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(5-ethyl-3-o-anisoyl-2-thienyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C25H27N2O3S+ MolecularWeight: 435.55848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C(=O)C4=CC=CC=C4OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C25H26N2O3S/c1-3-19-14-21(24(29)20-10-6-7-11-22(20)30-2)25(31-19)26-23(28)16-27-13-12-17-8-4-5-9-18(17)15-27/h4-11,14H,3,12-13,15-16H2,1-2H3,(H,26,28)/p+1