(E)-3-(3-ethoxy-4-hexoxy-phenyl)-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-(3-ethoxy-4-hexoxy-phenyl)-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-(3-ethoxy-4-hexoxy-phenyl)-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-(3-ethoxy-4-hexoxyphenyl)-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-(3-ethoxy-4-hexoxyphenyl)-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-(3-ethoxy-4-hexoxy-phenyl)-2-(2-thienyl)acrylic acid Formula: C21H26O4S MolecularWeight: 374.49374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C2=CC=CS2)C(=O)O)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(/C2=CC=CS2)\C(=O)O)OCC

InChI

InChI=1S/C21H26O4S/c1-3-5-6-7-12-25-18-11-10-16(15-19(18)24-4-2)14-17(21(22)23)20-9-8-13-26-20/h8-11,13-15H,3-7,12H2,1-2H3,(H,22,23)/b17-14-