2-[1-(4-dimethylaminophenyl)isoquinolin-5-yl]ethanenitrile

Systemtic Name: 2-[1-(4-dimethylaminophenyl)isoquinolin-5-yl]ethanenitrile Openeye Name: 2-[1-(4-dimethylaminophenyl)-5-isoquinolyl]acetonitrile CAS Name: 2-[1-(4-dimethylaminophenyl)-5-isoquinolinyl]acetonitrile IUPAC Name: 2-[1-(4-dimethylaminophenyl)isoquinolin-5-yl]acetonitrile Traditional Name: 2-[1-(4-dimethylaminophenyl)-5-isoquinolyl]acetonitrile Formula: C19H17N3 MolecularWeight: 287.35838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC#N

InChI

InChI=1S/C19H17N3/c1-22(2)16-8-6-15(7-9-16)19-18-5-3-4-14(10-12-20)17(18)11-13-21-19/h3-9,11,13H,10H2,1-2H3