3-(2-methoxyphenyl)-N-[2-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide

Systemtic Name: 3-(2-methoxyphenyl)-N-[2-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide Openeye Name: 3-(2-methoxyphenyl)-N-[2-(3-pyridylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide CAS Name: 3-(2-methoxyphenyl)-N-[2-(3-pyridinylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide IUPAC Name: 3-(2-methoxyphenyl)-N-[2-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide Traditional Name: 3-(2-methoxyphenyl)-N-[2-(3-pyridylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propionamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC(=O)NC2=CC3=C(CC[NH+](C3)CC4=CN=CC=C4)C=C2

Isomeric SMILES

COC1=CC=CC=C1CCC(=O)NC2=CC3=C(CC[NH+](C3)CC4=CN=CC=C4)C=C2

InChI

InChI=1S/C25H27N3O2/c1-30-24-7-3-2-6-21(24)9-11-25(29)27-23-10-8-20-12-14-28(18-22(20)15-23)17-19-5-4-13-26-16-19/h2-8,10,13,15-16H,9,11-12,14,17-18H2,1H3,(H,27,29)/p+1