5-[[2-[(2S,5R)-2-cyano-5-ethynyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]pentanoic acid

Systemtic Name: 5-[[2-[(2S,5R)-2-cyano-5-ethynyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]pentanoic acid Openeye Name: 5-[[2-[(2S,5R)-2-cyano-5-ethynyl-pyrrolidin-1-yl]-2-oxo-ethyl]amino]pentanoic acid CAS Name: 5-[[2-[(2S,5R)-2-cyano-5-ethynyl-1-pyrrolidinyl]-2-oxoethyl]amino]pentanoic acid IUPAC Name: 5-[[2-[(2S,5R)-2-cyano-5-ethynylpyrrolidin-1-yl]-2-oxoethyl]amino]pentanoic acid Traditional Name: 5-[[2-[(2S,5R)-2-cyano-5-ethynyl-pyrrolidino]-2-keto-ethyl]amino]valeric acid Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1CCC(N1C(=O)CNCCCCC(=O)O)C#N

Isomeric SMILES

C#C[C@H]1CC[C@H](N1C(=O)CNCCCCC(=O)O)C#N

InChI

InChI=1S/C14H19N3O3/c1-2-11-6-7-12(9-15)17(11)13(18)10-16-8-4-3-5-14(19)20/h1,11-12,16H,3-8,10H2,(H,19,20)/t11-,12-/m0/s1