2-[3-[3-(2,6-dimethoxy-3-thiophen-2-yl-phenyl)-3-oxidanylidene-prop-1-en-2-yl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[3-[3-(2,6-dimethoxy-3-thiophen-2-yl-phenyl)-3-oxidanylidene-prop-1-en-2-yl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[3-[1-[2,6-dimethoxy-3-(2-thienyl)benzoyl]vinyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[3-[3-(2,6-dimethoxy-3-thiophen-2-ylphenyl)-3-oxoprop-1-en-2-yl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[3-[3-(2,6-dimethoxy-3-thiophen-2-ylphenyl)-3-oxoprop-1-en-2-yl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[3-[1-[2,6-dimethoxy-3-(2-thienyl)benzoyl]vinyl]phenoxy]-2-methyl-propionic acid Formula: C25H24O6S MolecularWeight: 452.51946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=CC(=C1)C(=C)C(=O)C2=C(C=CC(=C2OC)C3=CC=CS3)OC

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=CC(=C1)C(=C)C(=O)C2=C(C=CC(=C2OC)C3=CC=CS3)OC

InChI

InChI=1S/C25H24O6S/c1-15(16-8-6-9-17(14-16)31-25(2,3)24(27)28)22(26)21-19(29-4)12-11-18(23(21)30-5)20-10-7-13-32-20/h6-14H,1H2,2-5H3,(H,27,28)