ethyl 8-[2-(4-octoxyphenyl)-4,5-diphenyl-imidazol-1-yl]octanoate

Systemtic Name: ethyl 8-[2-(4-octoxyphenyl)-4,5-diphenyl-imidazol-1-yl]octanoate Openeye Name: ethyl 8-[2-(4-octoxyphenyl)-4,5-diphenyl-imidazol-1-yl]octanoate CAS Name: 8-[2-(4-octoxyphenyl)-4,5-diphenyl-1-imidazolyl]octanoic acid ethyl ester IUPAC Name: ethyl 8-[2-(4-octoxyphenyl)-4,5-diphenylimidazol-1-yl]octanoate Traditional Name: 8-[2-(4-octoxyphenyl)-4,5-diphenyl-imidazol-1-yl]caprylic acid ethyl ester Formula: C39H50N2O3 MolecularWeight: 594.8259

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC(=C(N2CCCCCCCC(=O)OCC)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC(=C(N2CCCCCCCC(=O)OCC)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C39H50N2O3/c1-3-5-6-7-11-20-31-44-35-28-26-34(27-29-35)39-40-37(32-21-14-12-15-22-32)38(33-23-16-13-17-24-33)41(39)30-19-10-8-9-18-25-36(42)43-4-2/h12-17,21-24,26-29H,3-11,18-20,25,30-31H2,1-2H3