N-(2-methoxy-4-nitro-phenyl)-2-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]amino]ethanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]amino]ethanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-2-[2-pyrrolidin-1-yl-5-(trifluoromethyl)anilino]acetamide CAS Name: N-(2-methoxy-4-nitrophenyl)-2-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)anilino]acetamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-2-[2-pyrrolidin-1-yl-5-(trifluoromethyl)anilino]acetamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-2-[2-pyrrolidino-5-(trifluoromethyl)anilino]acetamide Formula: C20H21F3N4O4 MolecularWeight: 438.40035

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CNC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CNC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C20H21F3N4O4/c1-31-18-11-14(27(29)30)5-6-15(18)25-19(28)12-24-16-10-13(20(21,22)23)4-7-17(16)26-8-2-3-9-26/h4-7,10-11,24H,2-3,8-9,12H2,1H3,(H,25,28)