(2S,5S)-1-[(2S)-2-azanyl-2-cyclohexyl-ethanoyl]-5-ethynyl-pyrrolidine-2-carbonitrile

Systemtic Name: (2S,5S)-1-[(2S)-2-azanyl-2-cyclohexyl-ethanoyl]-5-ethynyl-pyrrolidine-2-carbonitrile Openeye Name: (2S,5S)-1-[(2S)-2-amino-2-cyclohexyl-acetyl]-5-ethynyl-pyrrolidine-2-carbonitrile CAS Name: (2S,5S)-1-[(2S)-2-amino-2-cyclohexyl-1-oxoethyl]-5-ethynyl-2-pyrrolidinecarbonitrile IUPAC Name: (2S,5S)-1-[(2S)-2-amino-2-cyclohexylacetyl]-5-ethynylpyrrolidine-2-carbonitrile Traditional Name: (2S,5S)-1-[(2S)-2-amino-2-cyclohexyl-acetyl]-5-ethynyl-pyrrolidine-2-carbonitrile Formula: C15H21N3O MolecularWeight: 259.34674

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1CCC(N1C(=O)C(C2CCCCC2)N)C#N

Isomeric SMILES

C#C[C@@H]1CC[C@H](N1C(=O)[C@H](C2CCCCC2)N)C#N

InChI

InChI=1S/C15H21N3O/c1-2-12-8-9-13(10-16)18(12)15(19)14(17)11-6-4-3-5-7-11/h1,11-14H,3-9,17H2/t12-,13+,14+/m1/s1