ditert-butyl (2S)-2-[(3-fluoranyl-4-nitro-phenoxy)carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[(3-fluoranyl-4-nitro-phenoxy)carbonylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[(3-fluoro-4-nitro-phenoxy)carbonylamino]pentanedioate CAS Name: (2S)-2-[[(3-fluoro-4-nitrophenoxy)-oxomethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[(3-fluoro-4-nitrophenoxy)carbonylamino]pentanedioate Traditional Name: (2S)-2-[(3-fluoro-4-nitro-phenoxy)carbonylamino]glutaric acid ditert-butyl ester Formula: C20H27FN2O8 MolecularWeight: 442.435383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)OC1=CC(=C(C=C1)[N+](=O)[O-])F

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)OC1=CC(=C(C=C1)[N+](=O)[O-])F

InChI

InChI=1S/C20H27FN2O8/c1-19(2,3)30-16(24)10-8-14(17(25)31-20(4,5)6)22-18(26)29-12-7-9-15(23(27)28)13(21)11-12/h7,9,11,14H,8,10H2,1-6H3,(H,22,26)/t14-/m0/s1