(4-decyl-2-fluoranyl-phenyl) 5-(4-dodecylphenyl)pyrazine-2-carboxylate

Systemtic Name: (4-decyl-2-fluoranyl-phenyl) 5-(4-dodecylphenyl)pyrazine-2-carboxylate Openeye Name: (4-decyl-2-fluoro-phenyl) 5-(4-dodecylphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-dodecylphenyl)-2-pyrazinecarboxylic acid (4-decyl-2-fluorophenyl) ester IUPAC Name: (4-decyl-2-fluorophenyl) 5-(4-dodecylphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-laurylphenyl)pyrazinic acid (4-decyl-2-fluoro-phenyl) ester Formula: C39H55FN2O2 MolecularWeight: 602.864603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)OC3=C(C=C(C=C3)CCCCCCCCCC)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)OC3=C(C=C(C=C3)CCCCCCCCCC)F

InChI

InChI=1S/C39H55FN2O2/c1-3-5-7-9-11-13-14-16-17-19-21-32-23-26-34(27-24-32)36-30-42-37(31-41-36)39(43)44-38-28-25-33(29-35(38)40)22-20-18-15-12-10-8-6-4-2/h23-31H,3-22H2,1-2H3