(4-hexylphenyl) 5-(4-pentoxyphenyl)pyrazine-2-carboxylate

Systemtic Name: (4-hexylphenyl) 5-(4-pentoxyphenyl)pyrazine-2-carboxylate Openeye Name: (4-hexylphenyl) 5-(4-pentoxyphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-pentoxyphenyl)-2-pyrazinecarboxylic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 5-(4-pentoxyphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-amoxyphenyl)pyrazinic acid (4-hexylphenyl) ester Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)OCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)OCCCCC

InChI

InChI=1S/C28H34N2O3/c1-3-5-7-8-10-22-11-15-25(16-12-22)33-28(31)27-21-29-26(20-30-27)23-13-17-24(18-14-23)32-19-9-6-4-2/h11-18,20-21H,3-10,19H2,1-2H3