(E)-3-[4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-[4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-[4-(2-fluorobenzyl)oxy-3-methoxy-phenyl]-2-(2-thienyl)acrylic acid Formula: C21H17FO4S MolecularWeight: 384.420683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C2=CC=CS2)C(=O)O)OCC3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C2=CC=CS2)\C(=O)O)OCC3=CC=CC=C3F

InChI

InChI=1S/C21H17FO4S/c1-25-19-12-14(11-16(21(23)24)20-7-4-10-27-20)8-9-18(19)26-13-15-5-2-3-6-17(15)22/h2-12H,13H2,1H3,(H,23,24)/b16-11-