(4-hexoxyphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate

Systemtic Name: (4-hexoxyphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate Openeye Name: (4-hexoxyphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-propylphenyl)-2-pyrazinecarboxylic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 5-(4-propylphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-propylphenyl)pyrazinic acid (4-hexoxyphenyl) ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)CCC

InChI

InChI=1S/C26H30N2O3/c1-3-5-6-7-17-30-22-13-15-23(16-14-22)31-26(29)25-19-27-24(18-28-25)21-11-9-20(8-4-2)10-12-21/h9-16,18-19H,3-8,17H2,1-2H3