1-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]ethanoylamino]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]ethanoylamino]cyclopropane-1-carboxylic acid Openeye Name: 1-[[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxo-ethyl]amino]acetyl]amino]cyclopropanecarboxylic acid CAS Name: 1-[[2-[[2-[(2S)-2-cyano-1-pyrrolidinyl]-2-oxoethyl]amino]-1-oxoethyl]amino]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]acetyl]amino]cyclopropane-1-carboxylic acid Traditional Name: 1-[[2-[[2-[(2S)-2-cyanopyrrolidino]-2-keto-ethyl]amino]acetyl]amino]cyclopropanecarboxylic acid Formula: C13H18N4O4 MolecularWeight: 294.30642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNCC(=O)NC2(CC2)C(=O)O)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CNCC(=O)NC2(CC2)C(=O)O)C#N

InChI

InChI=1S/C13H18N4O4/c14-6-9-2-1-5-17(9)11(19)8-15-7-10(18)16-13(3-4-13)12(20)21/h9,15H,1-5,7-8H2,(H,16,18)(H,20,21)/t9-/m0/s1