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

Systemtic Name: 2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[[2-(3-methyl-1-oxobutyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[[2-(3-methylbutanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[(2-isovaleryl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(tetrahydrofurfuryl)acetamide Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC(=O)NCC4CCCO4

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC(=O)NCC4CCCO4

InChI

InChI=1S/C27H34N2O4/c1-19(2)15-26(31)29-13-12-20-10-11-22(16-24(20)27(29)21-7-4-3-5-8-21)33-18-25(30)28-17-23-9-6-14-32-23/h3-5,7-8,10-11,16,19,23,27H,6,9,12-15,17-18H2,1-2H3,(H,28,30)