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

Systemtic Name: (2S,4S)-1-[2-(2-adamantylamino)ethanoyl]-4-fluoranyl-pyrrolidine-2-carbonitrile Openeye Name: (2S,4S)-1-[2-(2-adamantylamino)acetyl]-4-fluoro-pyrrolidine-2-carbonitrile CAS Name: (2S,4S)-1-[2-(2-adamantylamino)-1-oxoethyl]-4-fluoro-2-pyrrolidinecarbonitrile IUPAC Name: (2S,4S)-1-[2-(2-adamantylamino)acetyl]-4-fluoropyrrolidine-2-carbonitrile Traditional Name: (2S,4S)-1-[2-(2-adamantylamino)acetyl]-4-fluoro-pyrrolidine-2-carbonitrile Formula: C17H24FN3O MolecularWeight: 305.390363

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NCC(=O)N4CC(CC4C#N)F

Isomeric SMILES

C1[C@@H](CN([C@@H]1C#N)C(=O)CNC2C3CC4CC(C3)CC2C4)F

InChI

InChI=1S/C17H24FN3O/c18-14-6-15(7-19)21(9-14)16(22)8-20-17-12-2-10-1-11(4-12)5-13(17)3-10/h10-15,17,20H,1-6,8-9H2/t10?,11?,12?,13?,14-,15-,17?/m0/s1