12-[2-[4-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]phenoxy]dodecanoic acid

Systemtic Name: 12-[2-[4-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]phenoxy]dodecanoic acid Openeye Name: 12-[2-[4-(4-hydroxy-4-oxo-butoxy)phenyl]phenoxy]dodecanoic acid CAS Name: 12-[2-[4-(4-hydroxy-4-oxobutoxy)phenyl]phenoxy]dodecanoic acid IUPAC Name: 12-[2-[4-(4-hydroxy-4-oxobutoxy)phenyl]phenoxy]dodecanoic acid Traditional Name: 12-[2-[4-(4-hydroxy-4-keto-butoxy)phenyl]phenoxy]lauric acid Formula: C28H38O6 MolecularWeight: 470.59772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)OCCCC(=O)O)OCCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)OCCCC(=O)O)OCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C28H38O6/c29-27(30)15-8-6-4-2-1-3-5-7-11-21-34-26-14-10-9-13-25(26)23-17-19-24(20-18-23)33-22-12-16-28(31)32/h9-10,13-14,17-20H,1-8,11-12,15-16,21-22H2,(H,29,30)(H,31,32)