(4-octoxyphenyl) 5-(4-dodecoxyphenyl)pyrazine-2-carboxylate

Systemtic Name: (4-octoxyphenyl) 5-(4-dodecoxyphenyl)pyrazine-2-carboxylate Openeye Name: (4-octoxyphenyl) 5-(4-dodecoxyphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-dodecoxyphenyl)-2-pyrazinecarboxylic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 5-(4-dodecoxyphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-lauryloxyphenyl)pyrazinic acid (4-octoxyphenyl) ester Formula: C37H52N2O4 MolecularWeight: 588.81978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)OC3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)OC3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C37H52N2O4/c1-3-5-7-9-11-12-13-14-16-18-27-41-32-21-19-31(20-22-32)35-29-39-36(30-38-35)37(40)43-34-25-23-33(24-26-34)42-28-17-15-10-8-6-4-2/h19-26,29-30H,3-18,27-28H2,1-2H3