bis[4-(2-methylheptan-2-yl)phenyl] benzene-1,3-dicarboxylate

Systemtic Name: bis[4-(2-methylheptan-2-yl)phenyl] benzene-1,3-dicarboxylate Openeye Name: bis[4-(1,1-dimethylhexyl)phenyl] benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis[4-(2-methylheptan-2-yl)phenyl] ester IUPAC Name: bis[4-(2-methylheptan-2-yl)phenyl] benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis[4-(1,1-dimethylhexyl)phenyl] ester Formula: C36H46O4 MolecularWeight: 542.74804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H46O4/c1-7-9-11-24-35(3,4)29-16-20-31(21-17-29)39-33(37)27-14-13-15-28(26-27)34(38)40-32-22-18-30(19-23-32)36(5,6)25-12-10-8-2/h13-23,26H,7-12,24-25H2,1-6H3