2-chloranyl-5-fluoranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-5-fluoranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-(4-benzoylpiperazin-1-yl)-2-chloro-5-fluoro-benzonitrile CAS Name: 4-(4-benzoyl-1-piperazinyl)-2-chloro-5-fluorobenzonitrile IUPAC Name: 4-(4-benzoylpiperazin-1-yl)-2-chloro-5-fluorobenzonitrile Traditional Name: 4-(4-benzoylpiperazino)-2-chloro-5-fluoro-benzonitrile Formula: C18H15ClFN3O MolecularWeight: 343.782603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClFN3O/c19-15-11-17(16(20)10-14(15)12-21)22-6-8-23(9-7-22)18(24)13-4-2-1-3-5-13/h1-5,10-11H,6-9H2