2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]pentanedioic acid

Systemtic Name: 2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]pentanedioic acid Openeye Name: 2-[2-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]pentanedioic acid CAS Name: 2-[2-[[3-(2-quinolinylmethoxy)phenoxy]methyl]phenoxy]pentanedioic acid IUPAC Name: 2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]pentanedioic acid Traditional Name: 2-[2-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]glutaric acid Formula: C28H25NO7 MolecularWeight: 487.5006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)OCC4=CC=CC=C4OC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)OCC4=CC=CC=C4OC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C28H25NO7/c30-27(31)15-14-26(28(32)33)36-25-11-4-2-7-20(25)17-34-22-8-5-9-23(16-22)35-18-21-13-12-19-6-1-3-10-24(19)29-21/h1-13,16,26H,14-15,17-18H2,(H,30,31)(H,32,33)