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

Systemtic Name: 5-fluoranyl-3-[[4-fluoranyl-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)-4-fluoro-3-methyl-butanoyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[4-fluoro-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[4-fluoro-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxopentanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)-4-fluoro-3-methyl-butanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C18H22F2N2O6 MolecularWeight: 400.373886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22F2N2O6/c1-11(8-19)16(17(26)21-13(7-15(24)25)14(23)9-20)22-18(27)28-10-12-5-3-2-4-6-12/h2-6,11,13,16H,7-10H2,1H3,(H,21,26)(H,22,27)(H,24,25)