2-(1-oxidanylidene-2-propyl-isoquinolin-5-yl)oxyethanenitrile

Systemtic Name: 2-(1-oxidanylidene-2-propyl-isoquinolin-5-yl)oxyethanenitrile Openeye Name: 2-[(1-oxo-2-propyl-5-isoquinolyl)oxy]acetonitrile CAS Name: 2-[(1-oxo-2-propyl-5-isoquinolinyl)oxy]acetonitrile IUPAC Name: 2-(1-oxo-2-propylisoquinolin-5-yl)oxyacetonitrile Traditional Name: 2-[(1-keto-2-propyl-5-isoquinolyl)oxy]acetonitrile Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC2=C(C1=O)C=CC=C2OCC#N

Isomeric SMILES

CCCN1C=CC2=C(C1=O)C=CC=C2OCC#N

InChI

InChI=1S/C14H14N2O2/c1-2-8-16-9-6-11-12(14(16)17)4-3-5-13(11)18-10-7-15/h3-6,9H,2,8,10H2,1H3