bis[(4-hexylphenyl)methyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[(4-hexylphenyl)methyl] benzene-1,4-dicarboxylate Openeye Name: bis[(4-hexylphenyl)methyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[(4-hexylphenyl)methyl] ester IUPAC Name: bis[(4-hexylphenyl)methyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis(4-hexylbenzyl) ester Formula: C34H42O4 MolecularWeight: 514.69488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C34H42O4/c1-3-5-7-9-11-27-13-17-29(18-14-27)25-37-33(35)31-21-23-32(24-22-31)34(36)38-26-30-19-15-28(16-20-30)12-10-8-6-4-2/h13-24H,3-12,25-26H2,1-2H3