4-azanyl-2-[(3-bromanyl-5-fluoranyl-phenyl)carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[(3-bromanyl-5-fluoranyl-phenyl)carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[(3-bromo-5-fluoro-benzoyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[(3-bromo-5-fluorophenyl)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(3-bromo-5-fluorobenzoyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[(3-bromo-5-fluoro-benzoyl)amino]-4-keto-butyric acid Formula: C11H10BrFN2O4 MolecularWeight: 333.110503

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)Br)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1F)Br)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C11H10BrFN2O4/c12-6-1-5(2-7(13)3-6)10(17)15-8(11(18)19)4-9(14)16/h1-3,8H,4H2,(H2,14,16)(H,15,17)(H,18,19)