methyl 5-fluoranyl-3-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxidanylidene-pentanoate

Systemtic Name: methyl 5-fluoranyl-3-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxidanylidene-pentanoate Openeye Name: methyl 3-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-5-fluoro-4-oxo-pentanoate CAS Name: 5-fluoro-3-[[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-fluoro-3-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxopentanoate Traditional Name: 3-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-5-fluoro-4-keto-valeric acid methyl ester Formula: C19H25FN2O6 MolecularWeight: 396.410003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(CC(=O)OC)C(=O)CF)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H25FN2O6/c1-12(2)17(22-19(26)28-11-13-7-5-4-6-8-13)18(25)21-14(15(23)10-20)9-16(24)27-3/h4-8,12,14,17H,9-11H2,1-3H3,(H,21,25)(H,22,26)/t14?,17-/m0/s1