(3S,4S)-4-azanyl-5-[3,5-bis(fluoranyl)phenyl]-3-oxidanyl-pentanenitrile

Systemtic Name: (3S,4S)-4-azanyl-5-[3,5-bis(fluoranyl)phenyl]-3-oxidanyl-pentanenitrile Openeye Name: (3S,4S)-4-amino-5-(3,5-difluorophenyl)-3-hydroxy-pentanenitrile CAS Name: (3S,4S)-4-amino-5-(3,5-difluorophenyl)-3-hydroxypentanenitrile IUPAC Name: (3S,4S)-4-amino-5-(3,5-difluorophenyl)-3-hydroxypentanenitrile Traditional Name: (3S,4S)-4-amino-5-(3,5-difluorophenyl)-3-hydroxy-valeronitrile Formula: C11H12F2N2O MolecularWeight: 226.222586

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)CC(C(CC#N)O)N

Isomeric SMILES

C1=C(C=C(C=C1F)F)C[C@@H]([C@H](CC#N)O)N

InChI

InChI=1S/C11H12F2N2O/c12-8-3-7(4-9(13)6-8)5-10(15)11(16)1-2-14/h3-4,6,10-11,16H,1,5,15H2/t10-,11-/m0/s1