bis(4-hexylphenyl) pyridine-2,5-dicarboxylate

Systemtic Name: bis(4-hexylphenyl) pyridine-2,5-dicarboxylate Openeye Name: bis(4-hexylphenyl) pyridine-2,5-dicarboxylate CAS Name: pyridine-2,5-dicarboxylic acid bis(4-hexylphenyl) ester IUPAC Name: bis(4-hexylphenyl) pyridine-2,5-dicarboxylate Traditional Name: pyridine-2,5-dicarboxylic acid bis(4-hexylphenyl) ester Formula: C31H37NO4 MolecularWeight: 487.62978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OC(=O)C2=CN=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OC(=O)C2=CN=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C31H37NO4/c1-3-5-7-9-11-24-13-18-27(19-14-24)35-30(33)26-17-22-29(32-23-26)31(34)36-28-20-15-25(16-21-28)12-10-8-6-4-2/h13-23H,3-12H2,1-2H3