2-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-benzonitrile CAS Name: 2-[4-(4-fluorophenyl)-1-piperazinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-[4-(4-fluorophenyl)piperazino]-5-nitro-benzonitrile Formula: C17H15FN4O2 MolecularWeight: 326.325003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H15FN4O2/c18-14-1-3-15(4-2-14)20-7-9-21(10-8-20)17-6-5-16(22(23)24)11-13(17)12-19/h1-6,11H,7-10H2