methyl 3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C14H11BrFNO4S MolecularWeight: 388.208843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)COC2=C(C=C(C=C2)Br)F

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)COC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C14H11BrFNO4S/c1-20-14(19)13-10(4-5-22-13)17-12(18)7-21-11-3-2-8(15)6-9(11)16/h2-6H,7H2,1H3,(H,17,18)