(2S,4S)-1-[(2S)-2-azanyl-2-cyclohexyl-ethanoyl]-4-fluoranyl-pyrrolidine-2-carbonitrile

Systemtic Name: (2S,4S)-1-[(2S)-2-azanyl-2-cyclohexyl-ethanoyl]-4-fluoranyl-pyrrolidine-2-carbonitrile Openeye Name: (2S,4S)-1-[(2S)-2-amino-2-cyclohexyl-acetyl]-4-fluoro-pyrrolidine-2-carbonitrile CAS Name: (2S,4S)-1-[(2S)-2-amino-2-cyclohexyl-1-oxoethyl]-4-fluoro-2-pyrrolidinecarbonitrile IUPAC Name: (2S,4S)-1-[(2S)-2-amino-2-cyclohexylacetyl]-4-fluoropyrrolidine-2-carbonitrile Traditional Name: (2S,4S)-1-[(2S)-2-amino-2-cyclohexyl-acetyl]-4-fluoro-pyrrolidine-2-carbonitrile Formula: C13H20FN3O MolecularWeight: 253.315803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)N2CC(CC2C#N)F)N

Isomeric SMILES

C1CCC(CC1)[C@@H](C(=O)N2C[C@H](C[C@H]2C#N)F)N

InChI

InChI=1S/C13H20FN3O/c14-10-6-11(7-15)17(8-10)13(18)12(16)9-4-2-1-3-5-9/h9-12H,1-6,8,16H2/t10-,11-,12-/m0/s1