ditert-butyl 2-[(2-fluoranyl-4-nitro-phenyl)carbonylamino]pentanedioate

Systemtic Name: ditert-butyl 2-[(2-fluoranyl-4-nitro-phenyl)carbonylamino]pentanedioate Openeye Name: ditert-butyl 2-[(2-fluoro-4-nitro-benzoyl)amino]pentanedioate CAS Name: 2-[[(2-fluoro-4-nitrophenyl)-oxomethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(2-fluoro-4-nitrobenzoyl)amino]pentanedioate Traditional Name: 2-[(2-fluoro-4-nitro-benzoyl)amino]glutaric acid ditert-butyl ester Formula: C20H27FN2O7 MolecularWeight: 426.435983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27FN2O7/c1-19(2,3)29-16(24)10-9-15(18(26)30-20(4,5)6)22-17(25)13-8-7-12(23(27)28)11-14(13)21/h7-8,11,15H,9-10H2,1-6H3,(H,22,25)