2,4-didodecylbenzene-1,3-dicarboxylate

Systemtic Name: 2,4-didodecylbenzene-1,3-dicarboxylate Openeye Name: 2,4-didodecylbenzene-1,3-dicarboxylate CAS Name: 2,4-didodecylbenzene-1,3-dicarboxylate IUPAC Name: 2,4-didodecylbenzene-1,3-dicarboxylate Traditional Name: 2,4-dilaurylisophthalate Formula: C32H52O4-2 MolecularWeight: 500.75288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C(=C(C=C1)C(=O)[O-])CCCCCCCCCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC1=C(C(=C(C=C1)C(=O)[O-])CCCCCCCCCCCC)C(=O)[O-]

InChI

InChI=1S/C32H54O4/c1-3-5-7-9-11-13-15-17-19-21-23-27-25-26-29(31(33)34)28(30(27)32(35)36)24-22-20-18-16-14-12-10-8-6-4-2/h25-26H,3-24H2,1-2H3,(H,33,34)(H,35,36)/p-2