(2R)-3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]-2-methyl-propanenitrile

Systemtic Name: (2R)-3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]-2-methyl-propanenitrile Openeye Name: (2R)-3-[4-(2-chloro-6-fluoro-benzoyl)piperazin-1-yl]-2-methyl-propanenitrile CAS Name: (2R)-3-[4-[(2-chloro-6-fluorophenyl)-oxomethyl]-1-piperazinyl]-2-methylpropanenitrile IUPAC Name: (2R)-3-[4-(2-chloro-6-fluorobenzoyl)piperazin-1-yl]-2-methylpropanenitrile Traditional Name: (2R)-3-[4-(2-chloro-6-fluoro-benzoyl)piperazino]-2-methyl-propionitrile Formula: C15H17ClFN3O MolecularWeight: 309.766383

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C(=O)C2=C(C=CC=C2Cl)F)C#N

Isomeric SMILES

C[C@H](CN1CCN(CC1)C(=O)C2=C(C=CC=C2Cl)F)C#N

InChI

InChI=1S/C15H17ClFN3O/c1-11(9-18)10-19-5-7-20(8-6-19)15(21)14-12(16)3-2-4-13(14)17/h2-4,11H,5-8,10H2,1H3/t11-/m0/s1