[(2R)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(3-bromanylphenoxy)propanoate

Systemtic Name: [(2R)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(3-bromanylphenoxy)propanoate Openeye Name: [(1R)-2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl] 3-(3-bromophenoxy)propanoate CAS Name: 3-(3-bromophenoxy)propanoic acid [(2R)-1-(4-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-fluoroanilino)-1-oxopropan-2-yl] 3-(3-bromophenoxy)propanoate Traditional Name: 3-(3-bromophenoxy)propionic acid [(1R)-2-(4-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H17BrFNO4 MolecularWeight: 410.234283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)F)OC(=O)CCOC2=CC(=CC=C2)Br

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)F)OC(=O)CCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H17BrFNO4/c1-12(18(23)21-15-7-5-14(20)6-8-15)25-17(22)9-10-24-16-4-2-3-13(19)11-16/h2-8,11-12H,9-10H2,1H3,(H,21,23)/t12-/m1/s1