2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolyl]oxy]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolinyl]oxy]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[2-(2-ethoxyethyl)-1-oxoisoquinolin-5-yl]oxy-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[[2-(2-ethoxyethyl)-1-keto-5-isoquinolyl]oxy]-N-(4-fluorobenzyl)acetamide Formula: C22H23FN2O4 MolecularWeight: 398.427423

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN2O4/c1-2-28-13-12-25-11-10-18-19(22(25)27)4-3-5-20(18)29-15-21(26)24-14-16-6-8-17(23)9-7-16/h3-11H,2,12-15H2,1H3,(H,24,26)