[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl] 2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoate

Systemtic Name: [2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl] 2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoate Openeye Name: [2-[(1-morpholinocyclohexyl)methylamino]-2-oxo-ethyl] 2-(2-bromo-4-fluoro-phenoxy)acetate CAS Name: 2-(2-bromo-4-fluorophenoxy)acetic acid [2-[[1-(4-morpholinyl)cyclohexyl]methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl] 2-(2-bromo-4-fluorophenoxy)acetate Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)acetic acid [2-keto-2-[(1-morpholinocyclohexyl)methylamino]ethyl] ester Formula: C21H28BrFN2O5 MolecularWeight: 487.359823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)COC(=O)COC2=C(C=C(C=C2)F)Br)N3CCOCC3

Isomeric SMILES

C1CCC(CC1)(CNC(=O)COC(=O)COC2=C(C=C(C=C2)F)Br)N3CCOCC3

InChI

InChI=1S/C21H28BrFN2O5/c22-17-12-16(23)4-5-18(17)29-14-20(27)30-13-19(26)24-15-21(6-2-1-3-7-21)25-8-10-28-11-9-25/h4-5,12H,1-3,6-11,13-15H2,(H,24,26)