5-(3,5-dimethyl-4-phenylmethoxy-phenoxy)-2,2-dimethyl-pentanoic acid

Systemtic Name: 5-(3,5-dimethyl-4-phenylmethoxy-phenoxy)-2,2-dimethyl-pentanoic acid Openeye Name: 5-(4-benzyloxy-3,5-dimethyl-phenoxy)-2,2-dimethyl-pentanoic acid CAS Name: 5-(3,5-dimethyl-4-phenylmethoxyphenoxy)-2,2-dimethylpentanoic acid IUPAC Name: 5-(3,5-dimethyl-4-phenylmethoxyphenoxy)-2,2-dimethylpentanoic acid Traditional Name: 5-(4-benzoxy-3,5-dimethyl-phenoxy)-2,2-dimethyl-valeric acid Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=CC=C2)C)OCCCC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=CC=C2)C)OCCCC(C)(C)C(=O)O

InChI

InChI=1S/C22H28O4/c1-16-13-19(25-12-8-11-22(3,4)21(23)24)14-17(2)20(16)26-15-18-9-6-5-7-10-18/h5-7,9-10,13-14H,8,11-12,15H2,1-4H3,(H,23,24)