methyl (2S)-2-[1-(3-bromanyl-4-fluoranyl-phenyl)ethylamino]propanoate

Systemtic Name: methyl (2S)-2-[1-(3-bromanyl-4-fluoranyl-phenyl)ethylamino]propanoate Openeye Name: methyl (2S)-2-[1-(3-bromo-4-fluoro-phenyl)ethylamino]propanoate CAS Name: (2S)-2-[1-(3-bromo-4-fluorophenyl)ethylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[1-(3-bromo-4-fluorophenyl)ethylamino]propanoate Traditional Name: (2S)-2-[1-(3-bromo-4-fluoro-phenyl)ethylamino]propionic acid methyl ester Formula: C12H15BrFNO2 MolecularWeight: 304.155403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Br)NC(C)C(=O)OC

Isomeric SMILES

C[C@@H](C(=O)OC)NC(C)C1=CC(=C(C=C1)F)Br

InChI

InChI=1S/C12H15BrFNO2/c1-7(15-8(2)12(16)17-3)9-4-5-11(14)10(13)6-9/h4-8,15H,1-3H3/t7?,8-/m0/s1