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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCCC2=CC=CC=C2)C=C(C3=CC=CS3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OCCC2=CC=CC=C2)/C=C(/C3=CC=CS3)\C(=O)O

InChI

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