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

Systemtic Name: 2-[2-(5-bromanyl-2-ethoxy-phenyl)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(5-bromo-2-ethoxy-phenyl)thiazol-4-yl]acetic acid CAS Name: 2-[2-(5-bromo-2-ethoxyphenyl)-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(5-bromo-2-ethoxyphenyl)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(5-bromo-2-ethoxy-phenyl)thiazol-4-yl]acetic acid Formula: C13H12BrNO3S MolecularWeight: 342.20828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2=NC(=CS2)CC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C13H12BrNO3S/c1-2-18-11-4-3-8(14)5-10(11)13-15-9(7-19-13)6-12(16)17/h3-5,7H,2,6H2,1H3,(H,16,17)