2-[2-(5-bromanyl-2,3-dimethoxy-phenyl)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(5-bromanyl-2,3-dimethoxy-phenyl)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(5-bromo-2,3-dimethoxy-phenyl)thiazol-4-yl]acetic acid CAS Name: 2-[2-(5-bromo-2,3-dimethoxyphenyl)-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(5-bromo-2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(5-bromo-2,3-dimethoxy-phenyl)thiazol-4-yl]acetic acid Formula: C13H12BrNO4S MolecularWeight: 358.20768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C2=NC(=CS2)CC(=O)O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C2=NC(=CS2)CC(=O)O)OC

InChI

InChI=1S/C13H12BrNO4S/c1-18-10-4-7(14)3-9(12(10)19-2)13-15-8(6-20-13)5-11(16)17/h3-4,6H,5H2,1-2H3,(H,16,17)