2,2-bis(3,5,5-trimethylhexyl)pentanedioate

Systemtic Name: 2,2-bis(3,5,5-trimethylhexyl)pentanedioate Openeye Name: 2,2-bis(3,5,5-trimethylhexyl)pentanedioate CAS Name: 2,2-bis(3,5,5-trimethylhexyl)pentanedioate IUPAC Name: 2,2-bis(3,5,5-trimethylhexyl)pentanedioate Traditional Name: 2,2-bis(3,5,5-trimethylhexyl)glutarate Formula: C23H42O4-2 MolecularWeight: 382.57718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H44O4/c1-17(15-21(3,4)5)9-12-23(20(26)27,14-11-19(24)25)13-10-18(2)16-22(6,7)8/h17-18H,9-16H2,1-8H3,(H,24,25)(H,26,27)/p-2