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

Systemtic Name: (E)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-[2-(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=CC=CC(=C1OCC2=CC=CC=C2F)C=C(C3=CC=CS3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=CC=C2F)/C=C(/C3=CC=CS3)\C(=O)O

InChI

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