5-fluoranyl-3-[[(2S)-2-(methoxycarbonylamino)-3-methyl-butanoyl]amino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[[(2S)-2-(methoxycarbonylamino)-3-methyl-butanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-fluoro-3-[[(2S)-2-(methoxycarbonylamino)-3-methyl-butanoyl]amino]-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[(2S)-2-(methoxycarbonylamino)-3-methyl-1-oxobutyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]amino]-4-oxopentanoic acid Traditional Name: 3-[[(2S)-2-(carbomethoxyamino)-3-methyl-butanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C12H19FN2O6 MolecularWeight: 306.287463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OC

InChI

InChI=1S/C12H19FN2O6/c1-6(2)10(15-12(20)21-3)11(19)14-7(4-9(17)18)8(16)5-13/h6-7,10H,4-5H2,1-3H3,(H,14,19)(H,15,20)(H,17,18)/t7?,10-/m0/s1