4-[[4-(3-fluorophenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(3-fluorophenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(3-fluorobenzoyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(3-fluorobenzoyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(3-fluorobenzoyl)piperazino]methyl]benzonitrile Formula: C19H18FN3O MolecularWeight: 323.364123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18FN3O/c20-18-3-1-2-17(12-18)19(24)23-10-8-22(9-11-23)14-16-6-4-15(13-21)5-7-16/h1-7,12H,8-11,14H2