5-fluoranyl-3-[2-(1H-imidazol-2-ylcarbonylamino)butanoylamino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[2-(1H-imidazol-2-ylcarbonylamino)butanoylamino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-fluoro-3-[2-(1H-imidazole-2-carbonylamino)butanoylamino]-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[2-[[1H-imidazol-2-yl(oxo)methyl]amino]-1-oxobutyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[2-(1H-imidazole-2-carbonylamino)butanoylamino]-4-oxopentanoic acid Traditional Name: 5-fluoro-3-[2-(1H-imidazole-2-carbonylamino)butanoylamino]-4-keto-valeric acid Formula: C13H17FN4O5 MolecularWeight: 328.296283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)C1=NC=CN1

Isomeric SMILES

CCC(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)C1=NC=CN1

InChI

InChI=1S/C13H17FN4O5/c1-2-7(17-13(23)11-15-3-4-16-11)12(22)18-8(5-10(20)21)9(19)6-14/h3-4,7-8H,2,5-6H2,1H3,(H,15,16)(H,17,23)(H,18,22)(H,20,21)