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

Systemtic Name: bis[4-(2-methylheptan-2-yl)phenyl] benzene-1,2-dicarboxylate Openeye Name: bis[4-(1,1-dimethylhexyl)phenyl] benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis[4-(2-methylheptan-2-yl)phenyl] ester IUPAC Name: bis[4-(2-methylheptan-2-yl)phenyl] benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-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=C2C(=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=C2C(=O)OC3=CC=C(C=C3)C(C)(C)CCCCC

InChI

InChI=1S/C36H46O4/c1-7-9-13-25-35(3,4)27-17-21-29(22-18-27)39-33(37)31-15-11-12-16-32(31)34(38)40-30-23-19-28(20-24-30)36(5,6)26-14-10-8-2/h11-12,15-24H,7-10,13-14,25-26H2,1-6H3