5-fluoranyl-4-oxidanylidene-3-[[(2S)-2-[2-oxidanylidene-3-(propanoylamino)pyridin-1-yl]butanoyl]amino]pentanoic acid

Systemtic Name: 5-fluoranyl-4-oxidanylidene-3-[[(2S)-2-[2-oxidanylidene-3-(propanoylamino)pyridin-1-yl]butanoyl]amino]pentanoic acid Openeye Name: 5-fluoro-4-oxo-3-[[(2S)-2-[2-oxo-3-(propanoylamino)-1-pyridyl]butanoyl]amino]pentanoic acid CAS Name: 5-fluoro-4-oxo-3-[[(2S)-1-oxo-2-[2-oxo-3-(1-oxopropylamino)-1-pyridinyl]butyl]amino]pentanoic acid IUPAC Name: 5-fluoro-4-oxo-3-[[(2S)-2-[2-oxo-3-(propanoylamino)pyridin-1-yl]butanoyl]amino]pentanoic acid Traditional Name: 5-fluoro-4-keto-3-[[(2S)-2-(2-keto-3-propionamido-1-pyridyl)butanoyl]amino]valeric acid Formula: C17H22FN3O6 MolecularWeight: 383.371483

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC(=O)O)C(=O)CF)N1C=CC=C(C1=O)NC(=O)CC

Isomeric SMILES

CC[C@@H](C(=O)NC(CC(=O)O)C(=O)CF)N1C=CC=C(C1=O)NC(=O)CC

InChI

InChI=1S/C17H22FN3O6/c1-3-12(16(26)20-11(8-15(24)25)13(22)9-18)21-7-5-6-10(17(21)27)19-14(23)4-2/h5-7,11-12H,3-4,8-9H2,1-2H3,(H,19,23)(H,20,26)(H,24,25)/t11?,12-/m0/s1