2-[4-[3-(4-methoxycarbonyl-3-oxidanyl-2-propyl-phenoxy)propyl]phenyl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[3-(4-methoxycarbonyl-3-oxidanyl-2-propyl-phenoxy)propyl]phenyl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[3-(3-hydroxy-4-methoxycarbonyl-2-propyl-phenoxy)propyl]phenyl]-2-oxo-acetic acid CAS Name: 2-[4-[3-(3-hydroxy-4-methoxycarbonyl-2-propylphenoxy)propyl]phenyl]-2-oxoacetic acid IUPAC Name: 2-[4-[3-(3-hydroxy-4-methoxycarbonyl-2-propylphenoxy)propyl]phenyl]-2-oxoacetic acid Traditional Name: 2-[4-[3-(4-carbomethoxy-3-hydroxy-2-propyl-phenoxy)propyl]phenyl]-2-keto-acetic acid Formula: C22H24O7 MolecularWeight: 400.42176

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)OC)OCCCC2=CC=C(C=C2)C(=O)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)OC)OCCCC2=CC=C(C=C2)C(=O)C(=O)O

InChI

InChI=1S/C22H24O7/c1-3-5-16-18(12-11-17(20(16)24)22(27)28-2)29-13-4-6-14-7-9-15(10-8-14)19(23)21(25)26/h7-12,24H,3-6,13H2,1-2H3,(H,25,26)