2,2,3-tris(8-methylnonyl)hexanedioate

Systemtic Name: 2,2,3-tris(8-methylnonyl)hexanedioate Openeye Name: 2,2,3-tris(8-methylnonyl)hexanedioate CAS Name: 2,2,3-tris(8-methylnonyl)hexanedioate IUPAC Name: 2,2,3-tris(8-methylnonyl)hexanedioate Traditional Name: 2,2,3-tris(8-methylnonyl)adipate Formula: C36H68O4-2 MolecularWeight: 564.92272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCC(CCC(=O)[O-])C(CCCCCCCC(C)C)(CCCCCCCC(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)CCCCCCCC(CCC(=O)[O-])C(CCCCCCCC(C)C)(CCCCCCCC(C)C)C(=O)[O-]

InChI

InChI=1S/C36H70O4/c1-30(2)22-16-10-7-13-19-25-33(26-27-34(37)38)36(35(39)40,28-20-14-8-11-17-23-31(3)4)29-21-15-9-12-18-24-32(5)6/h30-33H,7-29H2,1-6H3,(H,37,38)(H,39,40)/p-2