2-[[2-cyclopropylcarbonyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethyl-butanamide

Systemtic Name: 2-[[2-cyclopropylcarbonyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethyl-butanamide Openeye Name: 2-[[2-(cyclopropanecarbonyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethyl-butanamide CAS Name: 2-[[2-[cyclopropyl(oxo)methyl]-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethylbutanamide IUPAC Name: 2-[[2-(cyclopropanecarbonyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethylbutanamide Traditional Name: 2-[[2-(cyclopropanecarbonyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethyl-butyramide Formula: C25H29FN2O3 MolecularWeight: 424.507763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC)OC1=CC2=C(CCN(C2C3=CC=C(C=C3)F)C(=O)C4CC4)C=C1

Isomeric SMILES

CCC(C(=O)NCC)OC1=CC2=C(CCN(C2C3=CC=C(C=C3)F)C(=O)C4CC4)C=C1

InChI

InChI=1S/C25H29FN2O3/c1-3-22(24(29)27-4-2)31-20-12-9-16-13-14-28(25(30)18-5-6-18)23(21(16)15-20)17-7-10-19(26)11-8-17/h7-12,15,18,22-23H,3-6,13-14H2,1-2H3,(H,27,29)