2-[4-[3-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-ynoyl]-2,6-dimethoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-ynoyl]-2,6-dimethoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[3-[2,4-dimethoxy-5-(2-thienyl)phenyl]prop-2-ynoyl]-2,6-dimethoxy-phenoxy]acetic acid CAS Name: 2-[4-[3-(2,4-dimethoxy-5-thiophen-2-ylphenyl)-1-oxoprop-2-ynyl]-2,6-dimethoxyphenoxy]acetic acid IUPAC Name: 2-[4-[3-(2,4-dimethoxy-5-thiophen-2-ylphenyl)prop-2-ynoyl]-2,6-dimethoxyphenoxy]acetic acid Traditional Name: 2-[4-[3-[2,4-dimethoxy-5-(2-thienyl)phenyl]propioloyl]-2,6-dimethoxy-phenoxy]acetic acid Formula: C25H22O8S MolecularWeight: 482.50238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC(=O)O)OC)C(=O)C#CC2=CC(=C(C=C2OC)OC)C3=CC=CS3

Isomeric SMILES

COC1=CC(=CC(=C1OCC(=O)O)OC)C(=O)C#CC2=CC(=C(C=C2OC)OC)C3=CC=CS3

InChI

InChI=1S/C25H22O8S/c1-29-19-13-20(30-2)17(23-6-5-9-34-23)10-15(19)7-8-18(26)16-11-21(31-3)25(22(12-16)32-4)33-14-24(27)28/h5-6,9-13H,14H2,1-4H3,(H,27,28)