2-[2-[[3-(quinolin-2-ylmethoxy)phenyl]sulfanylmethyl]phenoxy]propanoic acid

Systemtic Name: 2-[2-[[3-(quinolin-2-ylmethoxy)phenyl]sulfanylmethyl]phenoxy]propanoic acid Openeye Name: 2-[2-[[3-(2-quinolylmethoxy)phenyl]sulfanylmethyl]phenoxy]propanoic acid CAS Name: 2-[2-[[[3-(2-quinolinylmethoxy)phenyl]thio]methyl]phenoxy]propanoic acid IUPAC Name: 2-[2-[[3-(quinolin-2-ylmethoxy)phenyl]sulfanylmethyl]phenoxy]propanoic acid Traditional Name: 2-[2-[[[3-(2-quinolylmethoxy)phenyl]thio]methyl]phenoxy]propionic acid Formula: C26H23NO4S MolecularWeight: 445.53012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC=C1CSC2=CC=CC(=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC=C1CSC2=CC=CC(=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H23NO4S/c1-18(26(28)29)31-25-12-5-3-8-20(25)17-32-23-10-6-9-22(15-23)30-16-21-14-13-19-7-2-4-11-24(19)27-21/h2-15,18H,16-17H2,1H3,(H,28,29)