2-(2,4-ditert-butyl-6-pentyl-phenoxy)ethanoic acid

Systemtic Name: 2-(2,4-ditert-butyl-6-pentyl-phenoxy)ethanoic acid Openeye Name: 2-(2,4-ditert-butyl-6-pentyl-phenoxy)acetic acid CAS Name: 2-(2,4-ditert-butyl-6-pentylphenoxy)acetic acid IUPAC Name: 2-(2,4-ditert-butyl-6-pentylphenoxy)acetic acid Traditional Name: 2-(2-amyl-4,6-ditert-butyl-phenoxy)acetic acid Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)OCC(=O)O

Isomeric SMILES

CCCCCC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)OCC(=O)O

InChI

InChI=1S/C21H34O3/c1-8-9-10-11-15-12-16(20(2,3)4)13-17(21(5,6)7)19(15)24-14-18(22)23/h12-13H,8-11,14H2,1-7H3,(H,22,23)