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

Systemtic Name: (4-heptylphenyl) 5-(4-heptylphenyl)pyrazine-2-carboxylate Openeye Name: (4-heptylphenyl) 5-(4-heptylphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-heptylphenyl)-2-pyrazinecarboxylic acid (4-heptylphenyl) ester IUPAC Name: (4-heptylphenyl) 5-(4-heptylphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-heptylphenyl)pyrazinic acid (4-heptylphenyl) ester Formula: C31H40N2O2 MolecularWeight: 472.6615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)OC3=CC=C(C=C3)CCCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)OC3=CC=C(C=C3)CCCCCCC

InChI

InChI=1S/C31H40N2O2/c1-3-5-7-9-11-13-25-15-19-27(20-16-25)29-23-33-30(24-32-29)31(34)35-28-21-17-26(18-22-28)14-12-10-8-6-4-2/h15-24H,3-14H2,1-2H3