2-[[4-(4-fluorophenyl)carbonylpiperazin-1-yl]methyl]pentanedinitrile

Systemtic Name: 2-[[4-(4-fluorophenyl)carbonylpiperazin-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[4-(4-fluorobenzoyl)piperazin-1-yl]methyl]pentanedinitrile CAS Name: 2-[[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]methyl]pentanedinitrile IUPAC Name: 2-[[4-(4-fluorobenzoyl)piperazin-1-yl]methyl]pentanedinitrile Traditional Name: 2-[[4-(4-fluorobenzoyl)piperazino]methyl]glutaronitrile Formula: C17H19FN4O MolecularWeight: 314.357363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CCC#N)C#N)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1CN(CCN1CC(CCC#N)C#N)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H19FN4O/c18-16-5-3-15(4-6-16)17(23)22-10-8-21(9-11-22)13-14(12-20)2-1-7-19/h3-6,14H,1-2,8-11,13H2