2-[2-[[2-ethanoyl-5-(quinolin-2-ylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[[2-ethanoyl-5-(quinolin-2-ylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[[2-acetyl-5-(2-quinolylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]acetic acid CAS Name: 2-[2-[[2-acetyl-5-(2-quinolinylmethoxy)phenoxy]methyl]-6-methylphenoxy]acetic acid IUPAC Name: 2-[2-[[2-acetyl-5-(quinolin-2-ylmethoxy)phenoxy]methyl]-6-methylphenoxy]acetic acid Traditional Name: 2-[2-[[2-acetyl-5-(2-quinolylmethoxy)phenoxy]methyl]-6-methyl-phenoxy]acetic acid Formula: C28H25NO6 MolecularWeight: 471.5012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25NO6/c1-18-6-5-8-21(28(18)35-17-27(31)32)15-34-26-14-23(12-13-24(26)19(2)30)33-16-22-11-10-20-7-3-4-9-25(20)29-22/h3-14H,15-17H2,1-2H3,(H,31,32)