3-[4-(4-cyanophenyl)phenoxy]-2-[2-(2-oxidanylpropoxy)phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[4-(4-cyanophenyl)phenoxy]-2-[2-(2-oxidanylpropoxy)phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[4-(4-cyanophenyl)phenoxy]-2-[2-(2-hydroxypropoxy)phenyl]-2-isopropoxy-propanoic acid CAS Name: 3-[4-(4-cyanophenyl)phenoxy]-2-[2-(2-hydroxypropoxy)phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[4-(4-cyanophenyl)phenoxy]-2-[2-(2-hydroxypropoxy)phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 3-[4-(4-cyanophenyl)phenoxy]-2-[2-(2-hydroxypropoxy)phenyl]-2-isopropoxy-propionic acid Formula: C28H29NO6 MolecularWeight: 475.53296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(COC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)(C3=CC=CC=C3OCC(C)O)C(=O)O

Isomeric SMILES

CC(C)OC(COC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)(C3=CC=CC=C3OCC(C)O)C(=O)O

InChI

InChI=1S/C28H29NO6/c1-19(2)35-28(27(31)32,25-6-4-5-7-26(25)33-17-20(3)30)18-34-24-14-12-23(13-15-24)22-10-8-21(16-29)9-11-22/h4-15,19-20,30H,17-18H2,1-3H3,(H,31,32)