2-[5-(2-fluorophenyl)-1,3-benzoxazol-2-yl]-N-(4-nitrophenyl)pyrrolidine-1-carboxamide

Systemtic Name: 2-[5-(2-fluorophenyl)-1,3-benzoxazol-2-yl]-N-(4-nitrophenyl)pyrrolidine-1-carboxamide Openeye Name: 2-[5-(2-fluorophenyl)-1,3-benzoxazol-2-yl]-N-(4-nitrophenyl)pyrrolidine-1-carboxamide CAS Name: 2-[5-(2-fluorophenyl)-1,3-benzoxazol-2-yl]-N-(4-nitrophenyl)-1-pyrrolidinecarboxamide IUPAC Name: 2-[5-(2-fluorophenyl)-1,3-benzoxazol-2-yl]-N-(4-nitrophenyl)pyrrolidine-1-carboxamide Traditional Name: 2-[5-(2-fluorophenyl)-1,3-benzoxazol-2-yl]-N-(4-nitrophenyl)pyrrolidine-1-carboxamide Formula: C24H19FN4O4 MolecularWeight: 446.430463

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(O3)C=CC(=C4)C5=CC=CC=C5F

Isomeric SMILES

C1CC(N(C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(O3)C=CC(=C4)C5=CC=CC=C5F

InChI

InChI=1S/C24H19FN4O4/c25-19-5-2-1-4-18(19)15-7-12-22-20(14-15)27-23(33-22)21-6-3-13-28(21)24(30)26-16-8-10-17(11-9-16)29(31)32/h1-2,4-5,7-12,14,21H,3,6,13H2,(H,26,30)