(2S)-2-[(5-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]propanoic acid

Systemtic Name: (2S)-2-[(5-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]propanoic acid Openeye Name: (2S)-2-[(5-bromo-2-fluoro-phenyl)methylcarbamoylamino]propanoic acid CAS Name: (2S)-2-[[[(5-bromo-2-fluorophenyl)methylamino]-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[(5-bromo-2-fluorophenyl)methylcarbamoylamino]propanoic acid Traditional Name: (2S)-2-[(5-bromo-2-fluoro-benzyl)carbamoylamino]propionic acid Formula: C11H12BrFN2O3 MolecularWeight: 319.126983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)NCC1=C(C=CC(=C1)Br)F

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)NCC1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C11H12BrFN2O3/c1-6(10(16)17)15-11(18)14-5-7-4-8(12)2-3-9(7)13/h2-4,6H,5H2,1H3,(H,16,17)(H2,14,15,18)/t6-/m0/s1