3-[2-[[6-(2-methoxyethoxy)-1-oxidanylidene-2H-isoquinolin-7-yl]oxy]ethoxy]propanenitrile

Systemtic Name: 3-[2-[[6-(2-methoxyethoxy)-1-oxidanylidene-2H-isoquinolin-7-yl]oxy]ethoxy]propanenitrile Openeye Name: 3-[2-[[6-(2-methoxyethoxy)-1-oxo-2H-isoquinolin-7-yl]oxy]ethoxy]propanenitrile CAS Name: 3-[2-[[6-(2-methoxyethoxy)-1-oxo-2H-isoquinolin-7-yl]oxy]ethoxy]propanenitrile IUPAC Name: 3-[2-[[6-(2-methoxyethoxy)-1-oxo-2H-isoquinolin-7-yl]oxy]ethoxy]propanenitrile Traditional Name: 3-[2-[[1-keto-6-(2-methoxyethoxy)-2H-isoquinolin-7-yl]oxy]ethoxy]propionitrile Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)C=CNC2=O)OCCOCCC#N

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)C=CNC2=O)OCCOCCC#N

InChI

InChI=1S/C17H20N2O5/c1-21-7-9-23-15-11-13-3-5-19-17(20)14(13)12-16(15)24-10-8-22-6-2-4-18/h3,5,11-12H,2,6-10H2,1H3,(H,19,20)