2-(4-chloranyl-3-fluoranyl-phenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile

Systemtic Name: 2-(4-chloranyl-3-fluoranyl-phenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile Openeye Name: 2-(4-chloro-3-fluoro-phenyl)-2-(4-methylpiperazin-1-yl)acetonitrile CAS Name: 2-(4-chloro-3-fluorophenyl)-2-(4-methyl-1-piperazinyl)acetonitrile IUPAC Name: 2-(4-chloro-3-fluorophenyl)-2-(4-methylpiperazin-1-yl)acetonitrile Traditional Name: 2-(4-chloro-3-fluoro-phenyl)-2-(4-methylpiperazino)acetonitrile Formula: C13H15ClFN3 MolecularWeight: 267.729703

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(C#N)C2=CC(=C(C=C2)Cl)F

Isomeric SMILES

CN1CCN(CC1)C(C#N)C2=CC(=C(C=C2)Cl)F

InChI

InChI=1S/C13H15ClFN3/c1-17-4-6-18(7-5-17)13(9-16)10-2-3-11(14)12(15)8-10/h2-3,8,13H,4-7H2,1H3