2-[4-[2,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[2,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-(2,4-difluorobenzoyl)piperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-[(2,4-difluorophenyl)-oxomethyl]-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-(2,4-difluorobenzoyl)piperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-(2,4-difluorobenzoyl)piperazino]-6-fluoro-benzonitrile Formula: C18H14F3N3O MolecularWeight: 345.31847

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14F3N3O/c19-12-4-5-13(16(21)10-12)18(25)24-8-6-23(7-9-24)17-3-1-2-15(20)14(17)11-22/h1-5,10H,6-9H2