methyl 1-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C16H19BrFNO4 MolecularWeight: 388.228763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)COC2=C(C=C(C=C2)Br)F

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)COC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H19BrFNO4/c1-22-15(21)16(7-3-2-4-8-16)19-14(20)10-23-13-6-5-11(17)9-12(13)18/h5-6,9H,2-4,7-8,10H2,1H3,(H,19,20)