2-[[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C13H16BrFN2O3 MolecularWeight: 347.180143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)NC1=C(C=C(C=C1)Br)F

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)NC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H16BrFN2O3/c1-7(2)12(13(19)20)16-6-11(18)17-10-4-3-8(14)5-9(10)15/h3-5,7,12,16H,6H2,1-2H3,(H,17,18)(H,19,20)