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

Systemtic Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]acetamide CAS Name: 2-[[1-(4-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]acetamide Traditional Name: N-benzyl-2-[[1-(4-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]acetamide Formula: C27H27FN2O3 MolecularWeight: 446.513283

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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)NCC4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H27FN2O3/c1-2-26(32)30-15-14-20-10-13-23(16-24(20)27(30)21-8-11-22(28)12-9-21)33-18-25(31)29-17-19-6-4-3-5-7-19/h3-13,16,27H,2,14-15,17-18H2,1H3,(H,29,31)