4-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]butanenitrile

Systemtic Name: 4-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]butanenitrile Openeye Name: 4-[4-(3-fluorobenzoyl)piperazin-1-yl]butanenitrile CAS Name: 4-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]butanenitrile IUPAC Name: 4-[4-(3-fluorobenzoyl)piperazin-1-yl]butanenitrile Traditional Name: 4-[4-(3-fluorobenzoyl)piperazino]butyronitrile Formula: C15H18FN3O MolecularWeight: 275.321323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC#N)C(=O)C2=CC(=CC=C2)F

Isomeric SMILES

C1CN(CCN1CCCC#N)C(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C15H18FN3O/c16-14-5-3-4-13(12-14)15(20)19-10-8-18(9-11-19)7-2-1-6-17/h3-5,12H,1-2,7-11H2