(Z)-2-thiophen-2-yl-3-[4-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid

Systemtic Name: (Z)-2-thiophen-2-yl-3-[4-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid Openeye Name: (Z)-2-(2-thienyl)-3-[4-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid CAS Name: (Z)-2-thiophen-2-yl-3-[4-(2,3,6-trimethylphenoxy)phenyl]-2-propenoic acid IUPAC Name: (Z)-2-thiophen-2-yl-3-[4-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid Traditional Name: (Z)-2-(2-thienyl)-3-[4-(2,3,6-trimethylphenoxy)phenyl]acrylic acid Formula: C22H20O3S MolecularWeight: 364.4574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC2=CC=C(C=C2)C=C(C3=CC=CS3)C(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC2=CC=C(C=C2)/C=C(\C3=CC=CS3)/C(=O)O)C

InChI

InChI=1S/C22H20O3S/c1-14-6-7-15(2)21(16(14)3)25-18-10-8-17(9-11-18)13-19(22(23)24)20-5-4-12-26-20/h4-13H,1-3H3,(H,23,24)/b19-13+