2,4-bis(2-tert-butyl-4-ethyl-phenoxy)pentanedioic acid

Systemtic Name: 2,4-bis(2-tert-butyl-4-ethyl-phenoxy)pentanedioic acid Openeye Name: 2,4-bis(2-tert-butyl-4-ethyl-phenoxy)pentanedioic acid CAS Name: 2,4-bis(2-tert-butyl-4-ethylphenoxy)pentanedioic acid IUPAC Name: 2,4-bis(2-tert-butyl-4-ethylphenoxy)pentanedioic acid Traditional Name: 2,4-bis(2-tert-butyl-4-ethyl-phenoxy)glutaric acid Formula: C29H40O6 MolecularWeight: 484.6243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(CC(C(=O)O)OC2=C(C=C(C=C2)CC)C(C)(C)C)C(=O)O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(CC(C(=O)O)OC2=C(C=C(C=C2)CC)C(C)(C)C)C(=O)O)C(C)(C)C

InChI

InChI=1S/C29H40O6/c1-9-18-11-13-22(20(15-18)28(3,4)5)34-24(26(30)31)17-25(27(32)33)35-23-14-12-19(10-2)16-21(23)29(6,7)8/h11-16,24-25H,9-10,17H2,1-8H3,(H,30,31)(H,32,33)