2,2,3-tris[(1E)-cyclodecen-1-yl]hexanedioate

Systemtic Name: 2,2,3-tris[(1E)-cyclodecen-1-yl]hexanedioate Openeye Name: 2,2,3-tris[(1E)-cyclodecen-1-yl]hexanedioate CAS Name: 2,2,3-tris[(1E)-1-cyclodecenyl]hexanedioate IUPAC Name: 2,2,3-tris[(1E)-cyclodecen-1-yl]hexanedioate Traditional Name: 2,2,3-tris[(1E)-cyclodecen-1-yl]adipate Formula: C36H56O4-2 MolecularWeight: 552.82744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(=CCCC1)C(CCC(=O)[O-])C(C2=CCCCCCCCC2)(C3=CCCCCCCCC3)C(=O)[O-]

Isomeric SMILES

C1CCC/C=C(\CCCC1)/C(C(C(=O)[O-])(/C/2=C/CCCCCCCC2)/C/3=C/CCCCCCCC3)CCC(=O)[O-]

InChI

InChI=1S/C36H58O4/c37-34(38)29-28-33(30-22-16-10-4-1-5-11-17-23-30)36(35(39)40,31-24-18-12-6-2-7-13-19-25-31)32-26-20-14-8-3-9-15-21-27-32/h22,24,26,33H,1-21,23,25,27-29H2,(H,37,38)(H,39,40)/p-2/b30-22+,31-24+,32-26+