2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanenitrile

Systemtic Name: 2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanenitrile Openeye Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolyl]oxy]acetonitrile CAS Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolinyl]oxy]acetonitrile IUPAC Name: 2-[2-(2-ethoxyethyl)-1-oxoisoquinolin-5-yl]oxyacetonitrile Traditional Name: 2-[[2-(2-ethoxyethyl)-1-keto-5-isoquinolyl]oxy]acetonitrile Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC#N

Isomeric SMILES

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC#N

InChI

InChI=1S/C15H16N2O3/c1-2-19-11-9-17-8-6-12-13(15(17)18)4-3-5-14(12)20-10-7-16/h3-6,8H,2,9-11H2,1H3