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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolyl]oxy]acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolinyl]oxy]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[2-(2-methoxyethyl)-1-oxoisoquinolin-5-yl]oxyacetamide Traditional Name: N-(4-fluorobenzyl)-2-[[1-keto-2-(2-methoxyethyl)-5-isoquinolyl]oxy]acetamide Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O4/c1-27-12-11-24-10-9-17-18(21(24)26)3-2-4-19(17)28-14-20(25)23-13-15-5-7-16(22)8-6-15/h2-10H,11-14H2,1H3,(H,23,25)