tert-butyl 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[2-nitro-4-(trifluoromethyl)anilino]pyrrolidine-1-carboxylate CAS Name: 3-[2-nitro-4-(trifluoromethyl)anilino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-nitro-4-(trifluoromethyl)anilino]pyrrolidine-1-carboxylate Traditional Name: 3-[2-nitro-4-(trifluoromethyl)anilino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H20F3N3O4 MolecularWeight: 375.34291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H20F3N3O4/c1-15(2,3)26-14(23)21-7-6-11(9-21)20-12-5-4-10(16(17,18)19)8-13(12)22(24)25/h4-5,8,11,20H,6-7,9H2,1-3H3