2,4,5-tris[(1E)-cyclodecen-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: 2,4,5-tris[(1E)-cyclodecen-1-yl]benzene-1,3-dicarboxylate Openeye Name: 2,4,5-tris[(1E)-cyclodecen-1-yl]benzene-1,3-dicarboxylate CAS Name: 2,4,5-tris[(1E)-1-cyclodecenyl]benzene-1,3-dicarboxylate IUPAC Name: 2,4,5-tris[(1E)-cyclodecen-1-yl]benzene-1,3-dicarboxylate Traditional Name: 2,4,5-tris[(1E)-cyclodecen-1-yl]isophthalate Formula: C38H52O4-2 MolecularWeight: 572.81708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(=CCCC1)C2=CC(=C(C(=C2C3=CCCCCCCCC3)C(=O)[O-])C4=CCCCCCCCC4)C(=O)[O-]

Isomeric SMILES

C1CCCC/C(=C\CCC1)/C2=CC(=C(C(=C2/C/3=C/CCCCCCCC3)C(=O)[O-])/C/4=C/CCCCCCCC4)C(=O)[O-]

InChI

InChI=1S/C38H54O4/c39-37(40)33-28-32(29-22-16-10-4-1-5-11-17-23-29)34(30-24-18-12-6-2-7-13-19-25-30)36(38(41)42)35(33)31-26-20-14-8-3-9-15-21-27-31/h22,24,26,28H,1-21,23,25,27H2,(H,39,40)(H,41,42)/p-2/b29-22+,30-24+,31-26+