(2S)-2-[3,4-bis(fluoranyl)phenyl]-2-piperazin-1-yl-propanenitrile

Systemtic Name: (2S)-2-[3,4-bis(fluoranyl)phenyl]-2-piperazin-1-yl-propanenitrile Openeye Name: (2S)-2-(3,4-difluorophenyl)-2-piperazin-1-yl-propanenitrile CAS Name: (2S)-2-(3,4-difluorophenyl)-2-(1-piperazinyl)propanenitrile IUPAC Name: (2S)-2-(3,4-difluorophenyl)-2-piperazin-1-ylpropanenitrile Traditional Name: (2S)-2-(3,4-difluorophenyl)-2-piperazino-propionitrile Formula: C13H15F2N3 MolecularWeight: 251.275106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC(=C(C=C1)F)F)N2CCNCC2

Isomeric SMILES

C[C@@](C#N)(C1=CC(=C(C=C1)F)F)N2CCNCC2

InChI

InChI=1S/C13H15F2N3/c1-13(9-16,18-6-4-17-5-7-18)10-2-3-11(14)12(15)8-10/h2-3,8,17H,4-7H2,1H3/t13-/m1/s1