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

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

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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=CN=CC=C4

Isomeric SMILES

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

InChI

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