methyl 3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C16H15BrFNO4S MolecularWeight: 416.262003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrFNO4S/c1-22-16(21)8-12(14-3-2-6-24-14)19-15(20)9-23-13-5-4-10(17)7-11(13)18/h2-7,12H,8-9H2,1H3,(H,19,20)