2-octyl-1-[2-(3-phenylprop-2-ynoxy)ethyl]imidazo[4,5-c]quinolin-4-amine

Systemtic Name: 2-octyl-1-[2-(3-phenylprop-2-ynoxy)ethyl]imidazo[4,5-c]quinolin-4-amine Openeye Name: 2-octyl-1-[2-(3-phenylprop-2-ynoxy)ethyl]imidazo[4,5-c]quinolin-4-amine CAS Name: 2-octyl-1-[2-(3-phenylprop-2-ynoxy)ethyl]-4-imidazo[4,5-c]quinolinamine IUPAC Name: 2-octyl-1-[2-(3-phenylprop-2-ynoxy)ethyl]imidazo[4,5-c]quinolin-4-amine Traditional Name: [2-octyl-1-[2-(3-phenylprop-2-ynoxy)ethyl]imidazo[4,5-c]quinolin-4-yl]amine Formula: C29H34N4O MolecularWeight: 454.60646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NC2=C(N1CCOCC#CC3=CC=CC=C3)C4=CC=CC=C4N=C2N

Isomeric SMILES

CCCCCCCCC1=NC2=C(N1CCOCC#CC3=CC=CC=C3)C4=CC=CC=C4N=C2N

InChI

InChI=1S/C29H34N4O/c1-2-3-4-5-6-10-19-26-32-27-28(24-17-11-12-18-25(24)31-29(27)30)33(26)20-22-34-21-13-16-23-14-8-7-9-15-23/h7-9,11-12,14-15,17-18H,2-6,10,19-22H2,1H3,(H2,30,31)