[2-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-5-octoxy-phenyl] ethanoate

Systemtic Name: [2-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-5-octoxy-phenyl] ethanoate Openeye Name: [2-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-5-octoxy-phenyl] acetate CAS Name: acetic acid [2-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-5-octoxyphenyl] ester IUPAC Name: [2-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-5-octoxyphenyl] acetate Traditional Name: acetic acid [2-[4,6-bis(4-tert-butylphenyl)-s-triazin-2-yl]-5-octoxy-phenyl] ester Formula: C39H49N3O3 MolecularWeight: 607.82466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C2=NC(=NC(=N2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C2=NC(=NC(=N2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C)OC(=O)C

InChI

InChI=1S/C39H49N3O3/c1-9-10-11-12-13-14-25-44-32-23-24-33(34(26-32)45-27(2)43)37-41-35(28-15-19-30(20-16-28)38(3,4)5)40-36(42-37)29-17-21-31(22-18-29)39(6,7)8/h15-24,26H,9-14,25H2,1-8H3