2-[3-[2,4-bis(oxidanyl)phenyl]-3-methyl-butyl]octanoic acid

Systemtic Name: 2-[3-[2,4-bis(oxidanyl)phenyl]-3-methyl-butyl]octanoic acid Openeye Name: 2-[3-(2,4-dihydroxyphenyl)-3-methyl-butyl]octanoic acid CAS Name: 2-[3-(2,4-dihydroxyphenyl)-3-methylbutyl]octanoic acid IUPAC Name: 2-[3-(2,4-dihydroxyphenyl)-3-methylbutyl]octanoic acid Traditional Name: 2-[3-(2,4-dihydroxyphenyl)-3-methyl-butyl]caprylic acid Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC(C)(C)C1=C(C=C(C=C1)O)O)C(=O)O

Isomeric SMILES

CCCCCCC(CCC(C)(C)C1=C(C=C(C=C1)O)O)C(=O)O

InChI

InChI=1S/C19H30O4/c1-4-5-6-7-8-14(18(22)23)11-12-19(2,3)16-10-9-15(20)13-17(16)21/h9-10,13-14,20-21H,4-8,11-12H2,1-3H3,(H,22,23)