2-[2-methyl-6-[[3-(quinolin-2-ylmethoxymethyl)phenoxy]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-methyl-6-[[3-(quinolin-2-ylmethoxymethyl)phenoxy]methyl]phenoxy]ethanoic acid Openeye Name: 2-[2-methyl-6-[[3-(2-quinolylmethoxymethyl)phenoxy]methyl]phenoxy]acetic acid CAS Name: 2-[2-methyl-6-[[3-(2-quinolinylmethoxymethyl)phenoxy]methyl]phenoxy]acetic acid IUPAC Name: 2-[2-methyl-6-[[3-(quinolin-2-ylmethoxymethyl)phenoxy]methyl]phenoxy]acetic acid Traditional Name: 2-[2-methyl-6-[[3-(2-quinolylmethoxymethyl)phenoxy]methyl]phenoxy]acetic acid Formula: C27H25NO5 MolecularWeight: 443.4911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC=CC(=C2)COCC3=NC4=CC=CC=C4C=C3)OCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC=CC(=C2)COCC3=NC4=CC=CC=C4C=C3)OCC(=O)O

InChI

InChI=1S/C27H25NO5/c1-19-6-4-9-22(27(19)33-18-26(29)30)16-32-24-10-5-7-20(14-24)15-31-17-23-13-12-21-8-2-3-11-25(21)28-23/h2-14H,15-18H2,1H3,(H,29,30)