tert-butyl 2-cyano-1-(4-phenylpyrrolidin-2-yl)carbonyl-pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 2-cyano-1-(4-phenylpyrrolidin-2-yl)carbonyl-pyrrolidine-2-carboxylate Openeye Name: tert-butyl 2-cyano-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: 2-cyano-1-[oxo-(4-phenyl-2-pyrrolidinyl)methyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyano-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 2-cyano-1-(4-phenylprolyl)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCCN1C(=O)C2CC(CN2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCCN1C(=O)C2CC(CN2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H27N3O3/c1-20(2,3)27-19(26)21(14-22)10-7-11-24(21)18(25)17-12-16(13-23-17)15-8-5-4-6-9-15/h4-6,8-9,16-17,23H,7,10-13H2,1-3H3