2-[4-[3-[3-oxidanyl-4-(2-oxidanylideneethyl)-2-propyl-phenoxy]propoxy]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-[3-oxidanyl-4-(2-oxidanylideneethyl)-2-propyl-phenoxy]propoxy]phenoxy]ethanoic acid Openeye Name: 2-[4-[3-[3-hydroxy-4-(2-oxoethyl)-2-propyl-phenoxy]propoxy]phenoxy]acetic acid CAS Name: 2-[4-[3-[3-hydroxy-4-(2-oxoethyl)-2-propylphenoxy]propoxy]phenoxy]acetic acid IUPAC Name: 2-[4-[3-[3-hydroxy-4-(2-oxoethyl)-2-propylphenoxy]propoxy]phenoxy]acetic acid Traditional Name: 2-[4-[3-[3-hydroxy-4-(2-ketoethyl)-2-propyl-phenoxy]propoxy]phenoxy]acetic acid Formula: C22H26O7 MolecularWeight: 402.43764

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)CC=O)OCCCOC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)CC=O)OCCCOC2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C22H26O7/c1-2-4-19-20(10-5-16(11-12-23)22(19)26)28-14-3-13-27-17-6-8-18(9-7-17)29-15-21(24)25/h5-10,12,26H,2-4,11,13-15H2,1H3,(H,24,25)