2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(4-pyridylmethyl)propanamide CAS Name: 2-[[2-(3-methyl-1-oxobutyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 2-[(2-isovaleryl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(4-pyridylmethyl)propionamide Formula: C29H33N3O3 MolecularWeight: 471.59062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OC(C)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OC(C)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C29H33N3O3/c1-20(2)17-27(33)32-16-13-23-9-10-25(18-26(23)28(32)24-7-5-4-6-8-24)35-21(3)29(34)31-19-22-11-14-30-15-12-22/h4-12,14-15,18,20-21,28H,13,16-17,19H2,1-3H3,(H,31,34)