5-fluoranyl-3-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)-2-methyl-propanoyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[2-methyl-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxopentanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)-2-methyl-propanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C17H21FN2O6 MolecularWeight: 368.356843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H21FN2O6/c1-17(2,15(24)19-12(8-14(22)23)13(21)9-18)20-16(25)26-10-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,19,24)(H,20,25)(H,22,23)