2,2,3-trimethyl-3,4-bis(11-methyldodecyl)hexanedioate

Systemtic Name: 2,2,3-trimethyl-3,4-bis(11-methyldodecyl)hexanedioate Openeye Name: 2,2,3-trimethyl-3,4-bis(11-methyldodecyl)hexanedioate CAS Name: 2,2,3-trimethyl-3,4-bis(11-methyldodecyl)hexanedioate IUPAC Name: 2,2,3-trimethyl-3,4-bis(11-methyldodecyl)hexanedioate Traditional Name: 2,2,3-trimethyl-3,4-bis(11-methyldodecyl)adipate Formula: C35H66O4-2 MolecularWeight: 550.89614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCC(CC(=O)[O-])C(C)(CCCCCCCCCCC(C)C)C(C)(C)C(=O)[O-]

Isomeric SMILES

CC(C)CCCCCCCCCCC(CC(=O)[O-])C(C)(CCCCCCCCCCC(C)C)C(C)(C)C(=O)[O-]

InChI

InChI=1S/C35H68O4/c1-29(2)24-20-16-12-8-9-14-18-22-26-31(28-32(36)37)35(7,34(5,6)33(38)39)27-23-19-15-11-10-13-17-21-25-30(3)4/h29-31H,8-28H2,1-7H3,(H,36,37)(H,38,39)/p-2