2-[4-[3-(2,6-dimethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-2-thiophen-2-yl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[3-(2,6-dimethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-2-thiophen-2-yl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[1-(2,6-dimethoxybenzoyl)vinyl]-2-(2-thienyl)phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[3-(2,6-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]-2-thiophen-2-ylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[3-(2,6-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]-2-thiophen-2-ylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[1-(2,6-dimethoxybenzoyl)vinyl]-2-(2-thienyl)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=C(C=C(C=C1)C(=C)C(=O)C2=C(C=CC=C2OC)OC)C3=CC=CS3

Isomeric SMILES

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

InChI

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