(E)-3-[4-(2,6-dimethylphenoxy)phenyl]-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2,6-dimethylphenoxy)phenyl]-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-[4-(2,6-dimethylphenoxy)phenyl]-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-[4-(2,6-dimethylphenoxy)phenyl]-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-[4-(2,6-dimethylphenoxy)phenyl]-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-[4-(2,6-dimethylphenoxy)phenyl]-2-(2-thienyl)acrylic acid Formula: C21H18O3S MolecularWeight: 350.43082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=CC=C(C=C2)C=C(C3=CC=CS3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=CC=C(C=C2)/C=C(/C3=CC=CS3)\C(=O)O

InChI

InChI=1S/C21H18O3S/c1-14-5-3-6-15(2)20(14)24-17-10-8-16(9-11-17)13-18(21(22)23)19-7-4-12-25-19/h3-13H,1-2H3,(H,22,23)/b18-13-