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

Systemtic Name: 3-fluoranyl-4-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[4-(3-fluorobenzoyl)piperazin-1-yl]benzonitrile CAS Name: 3-fluoro-4-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]benzonitrile IUPAC Name: 3-fluoro-4-[4-(3-fluorobenzoyl)piperazin-1-yl]benzonitrile Traditional Name: 3-fluoro-4-[4-(3-fluorobenzoyl)piperazino]benzonitrile Formula: C18H15F2N3O MolecularWeight: 327.328006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C#N)F)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C#N)F)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H15F2N3O/c19-15-3-1-2-14(11-15)18(24)23-8-6-22(7-9-23)17-5-4-13(12-21)10-16(17)20/h1-5,10-11H,6-9H2