4-[2,3-bis(oxidanyl)-4-propan-2-yl-phenyl]-2-butoxy-3,5-dipropyl-benzoic acid

Systemtic Name: 4-[2,3-bis(oxidanyl)-4-propan-2-yl-phenyl]-2-butoxy-3,5-dipropyl-benzoic acid Openeye Name: 2-butoxy-4-(2,3-dihydroxy-4-isopropyl-phenyl)-3,5-dipropyl-benzoic acid CAS Name: 2-butoxy-4-(2,3-dihydroxy-4-propan-2-ylphenyl)-3,5-dipropylbenzoic acid IUPAC Name: 2-butoxy-4-(2,3-dihydroxy-4-propan-2-ylphenyl)-3,5-dipropylbenzoic acid Traditional Name: 2-butoxy-4-(2,3-dihydroxy-4-isopropyl-phenyl)-3,5-dipropyl-benzoic acid Formula: C26H36O5 MolecularWeight: 428.56104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C=C1C(=O)O)CCC)C2=C(C(=C(C=C2)C(C)C)O)O)CCC

Isomeric SMILES

CCCCOC1=C(C(=C(C=C1C(=O)O)CCC)C2=C(C(=C(C=C2)C(C)C)O)O)CCC

InChI

InChI=1S/C26H36O5/c1-6-9-14-31-25-20(11-8-3)22(17(10-7-2)15-21(25)26(29)30)19-13-12-18(16(4)5)23(27)24(19)28/h12-13,15-16,27-28H,6-11,14H2,1-5H3,(H,29,30)