2-(2-chloranyl-6-fluoranyl-phenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile hydrochloride

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile hydrochloride Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-2-(4-methylpiperazin-1-yl)acetonitrile hydrochloride CAS Name: 2-(2-chloro-6-fluorophenyl)-2-(4-methyl-1-piperazinyl)acetonitrile hydrochloride IUPAC Name: 2-(2-chloro-6-fluorophenyl)-2-(4-methylpiperazin-1-yl)acetonitrile hydrochloride Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-2-(4-methylpiperazino)acetonitrile hydrochloride Formula: C13H16Cl2FN3 MolecularWeight: 304.190643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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