1-methyl-4,5-bis[2-[3-(oxan-2-yloxymethyl)phenyl]ethynyl]-2-phenyl-imidazole

Systemtic Name: 1-methyl-4,5-bis[2-[3-(oxan-2-yloxymethyl)phenyl]ethynyl]-2-phenyl-imidazole Openeye Name: 1-methyl-2-phenyl-4,5-bis[2-[3-(tetrahydropyran-2-yloxymethyl)phenyl]ethynyl]imidazole CAS Name: 1-methyl-4,5-bis[2-[3-(2-oxanyloxymethyl)phenyl]ethynyl]-2-phenylimidazole IUPAC Name: 1-methyl-4,5-bis[2-[3-(oxan-2-yloxymethyl)phenyl]ethynyl]-2-phenylimidazole Traditional Name: 1-methyl-2-phenyl-4,5-bis[2-[3-(tetrahydropyran-2-yloxymethyl)phenyl]ethynyl]imidazole Formula: C38H38N2O4 MolecularWeight: 586.71932

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1C2=CC=CC=C2)C#CC3=CC(=CC=C3)COC4CCCCO4)C#CC5=CC(=CC=C5)COC6CCCCO6

Isomeric SMILES

CN1C(=C(N=C1C2=CC=CC=C2)C#CC3=CC(=CC=C3)COC4CCCCO4)C#CC5=CC(=CC=C5)COC6CCCCO6

InChI

InChI=1S/C38H38N2O4/c1-40-35(22-20-30-12-10-14-32(26-30)28-44-37-18-6-8-24-42-37)34(39-38(40)33-15-3-2-4-16-33)21-19-29-11-9-13-31(25-29)27-43-36-17-5-7-23-41-36/h2-4,9-16,25-26,36-37H,5-8,17-18,23-24,27-28H2,1H3