pyrrolidine-2-carbonitrile; 2,2,2-tris(fluoranyl)ethanoyl 4-(cyanomethyl)pyrrolidine-2-carboxylate

Systemtic Name: pyrrolidine-2-carbonitrile; 2,2,2-tris(fluoranyl)ethanoyl 4-(cyanomethyl)pyrrolidine-2-carboxylate Openeye Name: pyrrolidine-2-carbonitrile; (2,2,2-trifluoroacetyl) 4-(cyanomethyl)pyrrolidine-2-carboxylate CAS Name: 4-(cyanomethyl)-2-pyrrolidinecarboxylic acid (2,2,2-trifluoro-1-oxoethyl) ester; 2-pyrrolidinecarbonitrile IUPAC Name: pyrrolidine-2-carbonitrile; (2,2,2-trifluoroacetyl) 4-(cyanomethyl)pyrrolidine-2-carboxylate Traditional Name: 4-(cyanomethyl)pyrrolidine-2-carboxylic acid (2,2,2-trifluoroacetyl) ester; pyrrolidine-2-carbonitrile Formula: C14H17F3N4O3 MolecularWeight: 346.30499

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C#N.C1C(CNC1C(=O)OC(=O)C(F)(F)F)CC#N

Isomeric SMILES

C1CC(NC1)C#N.C1C(CNC1C(=O)OC(=O)C(F)(F)F)CC#N

InChI

InChI=1S/C9H9F3N2O3.C5H8N2/c10-9(11,12)8(16)17-7(15)6-3-5(1-2-13)4-14-6;6-4-5-2-1-3-7-5/h5-6,14H,1,3-4H2;5,7H,1-3H2