3-(3-ethynylphenoxy)-3-(2-oxidanylpropoxy)-2-phenyl-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-(3-ethynylphenoxy)-3-(2-oxidanylpropoxy)-2-phenyl-2-propan-2-yloxy-propanoic acid Openeye Name: 3-(3-ethynylphenoxy)-3-(2-hydroxypropoxy)-2-isopropoxy-2-phenyl-propanoic acid CAS Name: 3-(3-ethynylphenoxy)-3-(2-hydroxypropoxy)-2-phenyl-2-propan-2-yloxypropanoic acid IUPAC Name: 3-(3-ethynylphenoxy)-3-(2-hydroxypropoxy)-2-phenyl-2-propan-2-yloxypropanoic acid Traditional Name: 3-(3-ethynylphenoxy)-3-(2-hydroxypropoxy)-2-isopropoxy-2-phenyl-propionic acid Formula: C23H26O6 MolecularWeight: 398.44894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C1=CC=CC=C1)(C(OCC(C)O)OC2=CC=CC(=C2)C#C)C(=O)O

Isomeric SMILES

CC(C)OC(C1=CC=CC=C1)(C(OCC(C)O)OC2=CC=CC(=C2)C#C)C(=O)O

InChI

InChI=1S/C23H26O6/c1-5-18-10-9-13-20(14-18)28-22(27-15-17(4)24)23(21(25)26,29-16(2)3)19-11-7-6-8-12-19/h1,6-14,16-17,22,24H,15H2,2-4H3,(H,25,26)