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

Systemtic Name: 3-[2-(1H-benzimidazol-2-ylcarbonylamino)propanoylamino]-5-fluoranyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[2-(1H-benzimidazole-2-carbonylamino)propanoylamino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[2-[[1H-benzimidazol-2-yl(oxo)methyl]amino]-1-oxopropyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[2-(1H-benzimidazole-2-carbonylamino)propanoylamino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[2-(1H-benzimidazole-2-carbonylamino)propanoylamino]-5-fluoro-4-keto-valeric acid Formula: C16H17FN4O5 MolecularWeight: 364.328383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)C1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)C1=NC2=CC=CC=C2N1

InChI

InChI=1S/C16H17FN4O5/c1-8(15(25)21-11(6-13(23)24)12(22)7-17)18-16(26)14-19-9-4-2-3-5-10(9)20-14/h2-5,8,11H,6-7H2,1H3,(H,18,26)(H,19,20)(H,21,25)(H,23,24)