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

Systemtic Name: 2-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-(2-chloro-6-fluoro-benzyl)piperazino]methyl]benzonitrile Formula: C19H19ClFN3 MolecularWeight: 343.825663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2C#N)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2C#N)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H19ClFN3/c20-18-6-3-7-19(21)17(18)14-24-10-8-23(9-11-24)13-16-5-2-1-4-15(16)12-22/h1-7H,8-11,13-14H2