N2-tert-butyl-N1-(4-fluoranyl-3-nitro-phenyl)pyrrolidine-1,2-dicarboxamide

Systemtic Name: N2-tert-butyl-N1-(4-fluoranyl-3-nitro-phenyl)pyrrolidine-1,2-dicarboxamide Openeye Name: N2-tert-butyl-N1-(4-fluoro-3-nitro-phenyl)pyrrolidine-1,2-dicarboxamide CAS Name: N2-tert-butyl-N1-(4-fluoro-3-nitrophenyl)pyrrolidine-1,2-dicarboxamide IUPAC Name: 2-N-tert-butyl-1-N-(4-fluoro-3-nitrophenyl)pyrrolidine-1,2-dicarboxamide Traditional Name: N'-tert-butyl-N-(4-fluoro-3-nitro-phenyl)pyrrolidine-1,2-dicarboxamide Formula: C16H21FN4O4 MolecularWeight: 352.360743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CCCN1C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)C1CCCN1C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H21FN4O4/c1-16(2,3)19-14(22)12-5-4-8-20(12)15(23)18-10-6-7-11(17)13(9-10)21(24)25/h6-7,9,12H,4-5,8H2,1-3H3,(H,18,23)(H,19,22)