2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]nicotinonitrile Formula: C17H14F3N5O2 MolecularWeight: 377.32057

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=C(C=CC=N3)C#N

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=C(C=CC=N3)C#N

InChI

InChI=1S/C17H14F3N5O2/c18-17(19,20)13-3-4-14(15(10-13)25(26)27)23-6-8-24(9-7-23)16-12(11-21)2-1-5-22-16/h1-5,10H,6-9H2