2-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]ethanenitrile Openeye Name: 2-[4-[2-methoxy-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]acetonitrile CAS Name: 2-[4-[2-methoxy-8-[2-(3-pyridinyl)ethynyl]-1-imidazo[4,5-c]quinolinyl]phenyl]acetonitrile IUPAC Name: 2-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]acetonitrile Traditional Name: 2-[4-[2-methoxy-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]acetonitrile Formula: C26H17N5O MolecularWeight: 415.44608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CN=C3C=CC(=CC3=C2N1C4=CC=C(C=C4)CC#N)C#CC5=CN=CC=C5

Isomeric SMILES

COC1=NC2=CN=C3C=CC(=CC3=C2N1C4=CC=C(C=C4)CC#N)C#CC5=CN=CC=C5

InChI

InChI=1S/C26H17N5O/c1-32-26-30-24-17-29-23-11-8-19(4-5-20-3-2-14-28-16-20)15-22(23)25(24)31(26)21-9-6-18(7-10-21)12-13-27/h2-3,6-11,14-17H,12H2,1H3