[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoate

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoate Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-(2-bromo-4-fluoro-phenoxy)acetate CAS Name: 2-(2-bromo-4-fluorophenoxy)acetic acid [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] 2-(2-bromo-4-fluorophenoxy)acetate Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)acetic acid [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H21BrFNO4 MolecularWeight: 402.255343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)COC2=C(C=C(C=C2)F)Br

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCC1)OC(=O)COC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C17H21BrFNO4/c1-11(17(22)20-13-5-3-2-4-6-13)24-16(21)10-23-15-8-7-12(19)9-14(15)18/h7-9,11,13H,2-6,10H2,1H3,(H,20,22)/t11-/m0/s1