1-[2-(2-fluoranyl-4-nitro-3-oxidanyl-phenyl)pyrrolidin-1-yl]-2-phenylmethoxy-ethanone

Systemtic Name: 1-[2-(2-fluoranyl-4-nitro-3-oxidanyl-phenyl)pyrrolidin-1-yl]-2-phenylmethoxy-ethanone Openeye Name: 2-benzyloxy-1-[2-(2-fluoro-3-hydroxy-4-nitro-phenyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[2-(2-fluoro-3-hydroxy-4-nitrophenyl)-1-pyrrolidinyl]-2-phenylmethoxyethanone IUPAC Name: 1-[2-(2-fluoro-3-hydroxy-4-nitrophenyl)pyrrolidin-1-yl]-2-phenylmethoxyethanone Traditional Name: 2-benzoxy-1-[2-(2-fluoro-3-hydroxy-4-nitro-phenyl)pyrrolidino]ethanone Formula: C19H19FN2O5 MolecularWeight: 374.362963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)COCC2=CC=CC=C2)C3=C(C(=C(C=C3)[N+](=O)[O-])O)F

Isomeric SMILES

C1CC(N(C1)C(=O)COCC2=CC=CC=C2)C3=C(C(=C(C=C3)[N+](=O)[O-])O)F

InChI

InChI=1S/C19H19FN2O5/c20-18-14(8-9-16(19(18)24)22(25)26)15-7-4-10-21(15)17(23)12-27-11-13-5-2-1-3-6-13/h1-3,5-6,8-9,15,24H,4,7,10-12H2