2-[4-(4-bromophenyl)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-bromophenyl)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-bromophenyl)-2-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-bromophenyl)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-bromophenyl)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(4-bromophenyl)-2-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]thiazol-5-yl]acetic acid Formula: C22H20BrNO5S MolecularWeight: 490.3669

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrNO5S/c1-27-16-10-13(11-17(28-2)22(16)29-3)4-9-19-24-21(18(30-19)12-20(25)26)14-5-7-15(23)8-6-14/h4-11H,12H2,1-3H3,(H,25,26)/b9-4+