2-[3-[2-(4-azanylimidazo[4,5-c]quinolin-1-yl)ethoxy]prop-1-ynyl]benzenecarbonitrile

Systemtic Name: 2-[3-[2-(4-azanylimidazo[4,5-c]quinolin-1-yl)ethoxy]prop-1-ynyl]benzenecarbonitrile Openeye Name: 2-[3-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)ethoxy]prop-1-ynyl]benzonitrile CAS Name: 2-[3-[2-(4-amino-1-imidazo[4,5-c]quinolinyl)ethoxy]prop-1-ynyl]benzonitrile IUPAC Name: 2-[3-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)ethoxy]prop-1-ynyl]benzonitrile Traditional Name: 2-[3-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)ethoxy]prop-1-ynyl]benzonitrile Formula: C22H17N5O MolecularWeight: 367.40328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#CCOCCN2C=NC3=C2C4=CC=CC=C4N=C3N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C#CCOCCN2C=NC3=C2C4=CC=CC=C4N=C3N)C#N

InChI

InChI=1S/C22H17N5O/c23-14-17-7-2-1-6-16(17)8-5-12-28-13-11-27-15-25-20-21(27)18-9-3-4-10-19(18)26-22(20)24/h1-4,6-7,9-10,15H,11-13H2,(H2,24,26)