(2S,5R)-1-[(2S)-2-azanyl-3,3-dimethyl-butanoyl]-5-ethynyl-pyrrolidine-2-carbonitrile

Systemtic Name: (2S,5R)-1-[(2S)-2-azanyl-3,3-dimethyl-butanoyl]-5-ethynyl-pyrrolidine-2-carbonitrile Openeye Name: (2S,5R)-1-[(2S)-2-amino-3,3-dimethyl-butanoyl]-5-ethynyl-pyrrolidine-2-carbonitrile CAS Name: (2S,5R)-1-[(2S)-2-amino-3,3-dimethyl-1-oxobutyl]-5-ethynyl-2-pyrrolidinecarbonitrile IUPAC Name: (2S,5R)-1-[(2S)-2-amino-3,3-dimethylbutanoyl]-5-ethynylpyrrolidine-2-carbonitrile Traditional Name: (2S,5R)-1-[(2S)-2-amino-3,3-dimethyl-butanoyl]-5-ethynyl-pyrrolidine-2-carbonitrile Formula: C13H19N3O MolecularWeight: 233.30946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1C(CCC1C#N)C#C)N

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)N1[C@H](CC[C@H]1C#N)C#C)N

InChI

InChI=1S/C13H19N3O/c1-5-9-6-7-10(8-14)16(9)12(17)11(15)13(2,3)4/h1,9-11H,6-7,15H2,2-4H3/t9-,10-,11+/m0/s1