tert-butyl (2S,4S)-4-cyano-2-ethyl-2-(3-methylbutyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4S)-4-cyano-2-ethyl-2-(3-methylbutyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4S)-4-cyano-2-ethyl-2-isopentyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-4-cyano-2-ethyl-2-(3-methylbutyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S)-4-cyano-2-ethyl-2-(3-methylbutyl)pyrrolidine-1-carboxylate Traditional Name: (2S,4S)-4-cyano-2-ethyl-2-isoamyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H30N2O2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CN1C(=O)OC(C)(C)C)C#N)CCC(C)C

Isomeric SMILES

CC[C@@]1(C[C@@H](CN1C(=O)OC(C)(C)C)C#N)CCC(C)C

InChI

InChI=1S/C17H30N2O2/c1-7-17(9-8-13(2)3)10-14(11-18)12-19(17)15(20)21-16(4,5)6/h13-14H,7-10,12H2,1-6H3/t14-,17+/m1/s1