(4-heptylphenyl) 5-(4-pentylphenyl)pyrazine-2-carboxylate

Systemtic Name: (4-heptylphenyl) 5-(4-pentylphenyl)pyrazine-2-carboxylate Openeye Name: (4-heptylphenyl) 5-(4-pentylphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-pentylphenyl)-2-pyrazinecarboxylic acid (4-heptylphenyl) ester IUPAC Name: (4-heptylphenyl) 5-(4-pentylphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-amylphenyl)pyrazinic acid (4-heptylphenyl) ester Formula: C29H36N2O2 MolecularWeight: 444.60834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C29H36N2O2/c1-3-5-7-8-10-12-24-15-19-26(20-16-24)33-29(32)28-22-30-27(21-31-28)25-17-13-23(14-18-25)11-9-6-4-2/h13-22H,3-12H2,1-2H3