(E)-3-(4-methoxy-3-phenethyloxy-phenyl)-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-(4-methoxy-3-phenethyloxy-phenyl)-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-(4-methoxy-3-phenethyloxy-phenyl)-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-(4-methoxy-3-phenethyloxyphenyl)-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-(4-methoxy-3-phenethyloxyphenyl)-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-(4-methoxy-3-phenethyloxy-phenyl)-2-(2-thienyl)acrylic acid Formula: C22H20O4S MolecularWeight: 380.4568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C2=CC=CS2)C(=O)O)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(/C2=CC=CS2)\C(=O)O)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H20O4S/c1-25-19-10-9-17(14-18(22(23)24)21-8-5-13-27-21)15-20(19)26-12-11-16-6-3-2-4-7-16/h2-10,13-15H,11-12H2,1H3,(H,23,24)/b18-14-