1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanone Openeye Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(5-fluoro-2-nitro-phenoxy)ethanone CAS Name: 1-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-2-(5-fluoro-2-nitrophenoxy)ethanone IUPAC Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(5-fluoro-2-nitrophenoxy)ethanone Traditional Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidino]-2-(5-fluoro-2-nitro-phenoxy)ethanone Formula: C20H21FN2O6 MolecularWeight: 404.388943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H21FN2O6/c1-27-14-6-8-18(28-2)15(11-14)16-4-3-9-22(16)20(24)12-29-19-10-13(21)5-7-17(19)23(25)26/h5-8,10-11,16H,3-4,9,12H2,1-2H3