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

Systemtic Name: 2-[2-[[4-bromanyl-3-(quinolin-2-ylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[[4-bromo-3-(2-quinolylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]acetic acid CAS Name: 2-[2-[[4-bromo-3-(2-quinolinylmethoxy)phenoxy]methyl]-6-methylphenoxy]acetic acid IUPAC Name: 2-[2-[[4-bromo-3-(quinolin-2-ylmethoxy)phenoxy]methyl]-6-methylphenoxy]acetic acid Traditional Name: 2-[2-[[4-bromo-3-(2-quinolylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]acetic acid Formula: C26H22BrNO5 MolecularWeight: 508.36058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=C(C=C2)Br)OCC3=NC4=CC=CC=C4C=C3)OCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=C(C=C2)Br)OCC3=NC4=CC=CC=C4C=C3)OCC(=O)O

InChI

InChI=1S/C26H22BrNO5/c1-17-5-4-7-19(26(17)33-16-25(29)30)14-31-21-11-12-22(27)24(13-21)32-15-20-10-9-18-6-2-3-8-23(18)28-20/h2-13H,14-16H2,1H3,(H,29,30)