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

Systemtic Name: 3-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile Openeye Name: 3-[4-[2-methoxy-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile CAS Name: 3-[4-[2-methoxy-8-[2-(3-pyridinyl)ethynyl]-1-imidazo[4,5-c]quinolinyl]phenyl]propanenitrile IUPAC Name: 3-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile Traditional Name: 3-[4-[2-methoxy-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]propionitrile Formula: C27H19N5O MolecularWeight: 429.47266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H19N5O/c1-33-27-31-25-18-30-24-13-10-20(6-7-21-5-3-15-29-17-21)16-23(24)26(25)32(27)22-11-8-19(9-12-22)4-2-14-28/h3,5,8-13,15-18H,2,4H2,1H3