2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]propanoic acid

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]propanoic acid Openeye Name: 2-[(4-bromo-2-fluoro-phenyl)methylcarbamoylamino]propanoic acid CAS Name: 2-[[[(4-bromo-2-fluorophenyl)methylamino]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(4-bromo-2-fluorophenyl)methylcarbamoylamino]propanoic acid Traditional Name: 2-[(4-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=C(C=C1)Br)F

Isomeric SMILES

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

InChI

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