5-fluoranyl-4-oxidanylidene-3-[[(2S)-1-(phenylcarbonyl)piperidin-2-yl]carbonylamino]pentanoic acid

Systemtic Name: 5-fluoranyl-4-oxidanylidene-3-[[(2S)-1-(phenylcarbonyl)piperidin-2-yl]carbonylamino]pentanoic acid Openeye Name: 3-[[(2S)-1-benzoylpiperidine-2-carbonyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[[(2S)-1-benzoyl-2-piperidinyl]-oxomethyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[[(2S)-1-benzoylpiperidine-2-carbonyl]amino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[[(2S)-1-benzoylpipecoloyl]amino]-5-fluoro-4-keto-valeric acid Formula: C18H21FN2O5 MolecularWeight: 364.368143

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC(CC(=O)O)C(=O)CF)C(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)NC(CC(=O)O)C(=O)CF)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21FN2O5/c19-11-15(22)13(10-16(23)24)20-17(25)14-8-4-5-9-21(14)18(26)12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11H2,(H,20,25)(H,23,24)/t13?,14-/m0/s1