2-[2-butyl-4-(2,6-dimethyl-4-oxidanyl-phenyl)carbonyl-phenoxy]-3-methyl-butanoic acid

Systemtic Name: 2-[2-butyl-4-(2,6-dimethyl-4-oxidanyl-phenyl)carbonyl-phenoxy]-3-methyl-butanoic acid Openeye Name: 2-[2-butyl-4-(4-hydroxy-2,6-dimethyl-benzoyl)phenoxy]-3-methyl-butanoic acid CAS Name: 2-[2-butyl-4-[(4-hydroxy-2,6-dimethylphenyl)-oxomethyl]phenoxy]-3-methylbutanoic acid IUPAC Name: 2-[2-butyl-4-(4-hydroxy-2,6-dimethylbenzoyl)phenoxy]-3-methylbutanoic acid Traditional Name: 2-[2-butyl-4-(4-hydroxy-2,6-dimethyl-benzoyl)phenoxy]-3-methyl-butyric acid Formula: C24H30O5 MolecularWeight: 398.492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C(=O)C2=C(C=C(C=C2C)O)C)OC(C(C)C)C(=O)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C(=O)C2=C(C=C(C=C2C)O)C)OC(C(C)C)C(=O)O

InChI

InChI=1S/C24H30O5/c1-6-7-8-17-13-18(9-10-20(17)29-23(14(2)3)24(27)28)22(26)21-15(4)11-19(25)12-16(21)5/h9-14,23,25H,6-8H2,1-5H3,(H,27,28)