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

Systemtic Name: (4-heptylphenyl) 5-(4-hexylphenyl)pyrazine-2-carboxylate Openeye Name: (4-heptylphenyl) 5-(4-hexylphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-hexylphenyl)-2-pyrazinecarboxylic acid (4-heptylphenyl) ester IUPAC Name: (4-heptylphenyl) 5-(4-hexylphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-hexylphenyl)pyrazinic acid (4-heptylphenyl) ester Formula: C30H38N2O2 MolecularWeight: 458.63492

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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)CCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C30H38N2O2/c1-3-5-7-9-11-13-25-16-20-27(21-17-25)34-30(33)29-23-31-28(22-32-29)26-18-14-24(15-19-26)12-10-8-6-4-2/h14-23H,3-13H2,1-2H3