2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-(2-chloro-4-fluoro-benzyl)piperazino]-6-fluoro-benzonitrile Formula: C18H16ClF2N3 MolecularWeight: 347.789546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C3=C(C(=CC=C3)F)C#N

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C3=C(C(=CC=C3)F)C#N

InChI

InChI=1S/C18H16ClF2N3/c19-16-10-14(20)5-4-13(16)12-23-6-8-24(9-7-23)18-3-1-2-17(21)15(18)11-22/h1-5,10H,6-9,12H2