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4-[3,4-bis(2-methylpropyl)phenoxy]carbonyl-2,3-diethyl-6-fluoranyl-benzoic acid

4-[3,4-bis(2-methylpropyl)phenoxy]carbonyl-2,3-diethyl-6-fluoranyl-benzoic acid

Systemtic Name:4-[3,4-bis(2-methylpropyl)phenoxy]carbonyl-2,3-diethyl-6-fluoranyl-benzoic acid
Openeye Name:4-(3,4-diisobutylphenoxy)carbonyl-2,3-diethyl-6-fluoro-benzoic acid
CAS Name:4-[[3,4-bis(2-methylpropyl)phenoxy]-oxomethyl]-2,3-diethyl-6-fluorobenzoic acid
IUPAC Name:4-[3,4-bis(2-methylpropyl)phenoxy]carbonyl-2,3-diethyl-6-fluorobenzoic acid
Traditional Name:4-(3,4-diisobutylphenoxy)carbonyl-2,3-diethyl-6-fluoro-benzoic acid
Formula: C26H33FO4
MolecularWeight: 428.536223
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1C(=O)OC2=CC(=C(C=C2)CC(C)C)CC(C)C)F)C(=O)O)CC


Isomeric SMILES

CCC1=C(C(=C(C=C1C(=O)OC2=CC(=C(C=C2)CC(C)C)CC(C)C)F)C(=O)O)CC


InChI

InChI=1S/C26H33FO4/c1-7-20-21(8-2)24(25(28)29)23(27)14-22(20)26(30)31-19-10-9-17(11-15(3)4)18(13-19)12-16(5)6/h9-10,13-16H,7-8,11-12H2,1-6H3,(H,28,29)


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