2,2-dimethyl-5-(4-octylphenoxy)pentanoic acid

Systemtic Name: 2,2-dimethyl-5-(4-octylphenoxy)pentanoic acid Openeye Name: 2,2-dimethyl-5-(4-octylphenoxy)pentanoic acid CAS Name: 2,2-dimethyl-5-(4-octylphenoxy)pentanoic acid IUPAC Name: 2,2-dimethyl-5-(4-octylphenoxy)pentanoic acid Traditional Name: 2,2-dimethyl-5-(4-octylphenoxy)valeric acid Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OCCCC(C)(C)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OCCCC(C)(C)C(=O)O

InChI

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