2-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-propan-2-yl-propanamide

Systemtic Name: 2-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-propan-2-yl-propanamide Openeye Name: 2-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isopropyl-N-methyl-propanamide CAS Name: 2-[[1-(4-fluorophenyl)-2-(3-methyl-1-oxobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-propan-2-ylpropanamide IUPAC Name: 2-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-propan-2-ylpropanamide Traditional Name: 2-[[1-(4-fluorophenyl)-2-isovaleryl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isopropyl-N-methyl-propionamide Formula: C27H35FN2O3 MolecularWeight: 454.576803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OC(C)C(=O)N(C)C(C)C

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OC(C)C(=O)N(C)C(C)C

InChI

InChI=1S/C27H35FN2O3/c1-17(2)15-25(31)30-14-13-20-9-12-23(33-19(5)27(32)29(6)18(3)4)16-24(20)26(30)21-7-10-22(28)11-8-21/h7-12,16-19,26H,13-15H2,1-6H3