1-(4-fluoranyl-3-nitro-phenyl)-5-oxidanylidene-N-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-fluoranyl-3-nitro-phenyl)-5-oxidanylidene-N-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: 1-(4-fluoro-3-nitro-phenyl)-5-oxo-N-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide CAS Name: 1-(4-fluoro-3-nitrophenyl)-5-oxo-N-(3,4,5-trimethoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-fluoro-3-nitrophenyl)-5-oxo-N-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: 1-(4-fluoro-3-nitro-phenyl)-5-keto-N-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Formula: C20H20FN3O7 MolecularWeight: 433.387103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H20FN3O7/c1-29-16-7-12(8-17(30-2)19(16)31-3)22-20(26)11-6-18(25)23(10-11)13-4-5-14(21)15(9-13)24(27)28/h4-5,7-9,11H,6,10H2,1-3H3,(H,22,26)