2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)ethanamide Openeye Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isopentyl-acetamide CAS Name: 2-[[1-(4-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)acetamide Traditional Name: 2-[[1-(4-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isoamyl-acetamide Formula: C25H31FN2O3 MolecularWeight: 426.523643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC(=O)NCCC(C)C

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC(=O)NCCC(C)C

InChI

InChI=1S/C25H31FN2O3/c1-4-24(30)28-14-12-18-7-10-21(31-16-23(29)27-13-11-17(2)3)15-22(18)25(28)19-5-8-20(26)9-6-19/h5-10,15,17,25H,4,11-14,16H2,1-3H3,(H,27,29)