ethyl (2S)-2-[(5-bromanyl-4-oxidanyl-pentanoyl)amino]-4-fluoranyl-4-methyl-pentanoate

Systemtic Name: ethyl (2S)-2-[(5-bromanyl-4-oxidanyl-pentanoyl)amino]-4-fluoranyl-4-methyl-pentanoate Openeye Name: ethyl (2S)-2-[(5-bromo-4-hydroxy-pentanoyl)amino]-4-fluoro-4-methyl-pentanoate CAS Name: (2S)-2-[(5-bromo-4-hydroxy-1-oxopentyl)amino]-4-fluoro-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(5-bromo-4-hydroxypentanoyl)amino]-4-fluoro-4-methylpentanoate Traditional Name: (2S)-2-[(5-bromo-4-hydroxy-pentanoyl)amino]-4-fluoro-4-methyl-valeric acid ethyl ester Formula: C13H23BrFNO4 MolecularWeight: 356.228423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)(C)F)NC(=O)CCC(CBr)O

Isomeric SMILES

CCOC(=O)[C@H](CC(C)(C)F)NC(=O)CCC(CBr)O

InChI

InChI=1S/C13H23BrFNO4/c1-4-20-12(19)10(7-13(2,3)15)16-11(18)6-5-9(17)8-14/h9-10,17H,4-8H2,1-3H3,(H,16,18)/t9?,10-/m0/s1