2,2-bis(2,2-dimethyloctyl)nonanedioate

Systemtic Name: 2,2-bis(2,2-dimethyloctyl)nonanedioate Openeye Name: 2,2-bis(2,2-dimethyloctyl)nonanedioate CAS Name: 2,2-bis(2,2-dimethyloctyl)nonanedioate IUPAC Name: 2,2-bis(2,2-dimethyloctyl)nonanedioate Traditional Name: 2,2-bis(2,2-dimethyloctyl)azelaate Formula: C29H54O4-2 MolecularWeight: 466.73666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)CC(CCCCCCC(=O)[O-])(CC(C)(C)CCCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCC(C)(C)CC(CCCCCCC(=O)[O-])(CC(C)(C)CCCCCC)C(=O)[O-]

InChI

InChI=1S/C29H56O4/c1-7-9-11-16-20-27(3,4)23-29(26(32)33,22-18-14-13-15-19-25(30)31)24-28(5,6)21-17-12-10-8-2/h7-24H2,1-6H3,(H,30,31)(H,32,33)/p-2