2-[2-methyl-6-[[3-(pyridin-4-ylmethoxy)phenoxy]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-methyl-6-[[3-(pyridin-4-ylmethoxy)phenoxy]methyl]phenoxy]ethanoic acid Openeye Name: 2-[2-methyl-6-[[3-(4-pyridylmethoxy)phenoxy]methyl]phenoxy]acetic acid CAS Name: 2-[2-methyl-6-[[3-(pyridin-4-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid IUPAC Name: 2-[2-methyl-6-[[3-(pyridin-4-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid Traditional Name: 2-[2-methyl-6-[[3-(4-pyridylmethoxy)phenoxy]methyl]phenoxy]acetic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=CC=NC=C3)OCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=CC=NC=C3)OCC(=O)O

InChI

InChI=1S/C22H21NO5/c1-16-4-2-5-18(22(16)28-15-21(24)25)14-27-20-7-3-6-19(12-20)26-13-17-8-10-23-11-9-17/h2-12H,13-15H2,1H3,(H,24,25)