2-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoyl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]thiazole-4-carboxylate CAS Name: 2-[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]-4-thiazolecarboxylate IUPAC Name: 2-[2-(4-bromo-2,6-dimethylphenoxy)acetyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]thiazole-4-carboxylate Formula: C14H11BrNO4S- MolecularWeight: 369.21044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)C2=NC(=CS2)C(=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)C2=NC(=CS2)C(=O)[O-])C)Br

InChI

InChI=1S/C14H12BrNO4S/c1-7-3-9(15)4-8(2)12(7)20-5-11(17)13-16-10(6-21-13)14(18)19/h3-4,6H,5H2,1-2H3,(H,18,19)/p-1