tert-butyl 3-cyano-3-pyridin-4-yl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-cyano-3-pyridin-4-yl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-cyano-3-(4-pyridyl)pyrrolidine-1-carboxylate CAS Name: 3-cyano-3-pyridin-4-yl-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-cyano-3-pyridin-4-ylpyrrolidine-1-carboxylate Traditional Name: 3-cyano-3-(4-pyridyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)(C#N)C2=CC=NC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)(C#N)C2=CC=NC=C2

InChI

InChI=1S/C15H19N3O2/c1-14(2,3)20-13(19)18-9-6-15(10-16,11-18)12-4-7-17-8-5-12/h4-5,7-8H,6,9,11H2,1-3H3