3-nitro-4-pyrrolidin-1-yl-N-[2,2,2-tris(fluoranyl)ethyl]benzamide

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-[2,2,2-tris(fluoranyl)ethyl]benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-(2,2,2-trifluoroethyl)benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-(2,2,2-trifluoroethyl)benzamide Formula: C13H14F3N3O3 MolecularWeight: 317.26377

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H14F3N3O3/c14-13(15,16)8-17-12(20)9-3-4-10(11(7-9)19(21)22)18-5-1-2-6-18/h3-4,7H,1-2,5-6,8H2,(H,17,20)